data_2h3c_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 2h3c _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 ' 2' ' ' LYS . . . . . 0.715 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 17.9 mmtm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 121.002 0.43 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.493 ' O ' ' N ' ' B' ' 109' ' ' VAL . 56.0 tt0 -112.35 120.4 41.56 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.205 0.526 . . . . 0.0 111.858 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.736 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.4 OUTLIER -77.9 109.1 11.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.999 0.904 . . . . 0.0 111.798 -179.013 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.754 HG23 ' CD2' ' B' ' 114' ' ' TYR . 0.4 OUTLIER -110.65 117.16 54.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.379 178.514 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.861 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -133.1 134.37 44.17 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 118.262 -1.375 . . . . 0.0 114.48 -177.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.446 HG13 ' HB ' ' B' ' 124' ' ' ILE . 1.4 m -99.72 111.68 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.558 ' CG2' ' NE ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -71.6 67.85 0.56 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.013 -0.43 . . . . 0.0 111.975 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.469 ' HB ' ' HB2' ' A' ' 12' ' ' ASP . 3.2 m -99.03 -120.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.721 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.667 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 6.1 t70 157.61 -85.09 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.681 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -102.04 12.36 36.97 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 119.237 -0.411 . . . . 0.0 112.094 178.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.55 ' C ' ' H ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -73.43 60.39 0.63 Allowed 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.355 0.98 . . . . 0.0 108.47 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.54 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 48.8 m 61.52 -23.54 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.728 ' CG ' HG23 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -48.5 -60.63 2.53 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 123.173 0.589 . . . . 0.0 111.07 179.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.681 ' HG2' ' HA ' ' A' ' 11' ' ' SER . 0.8 OUTLIER -48.95 -36.94 18.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.804 -176.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 19' ' ' ALA . 0.2 OUTLIER -59.34 -49.52 77.5 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.766 ' HG ' ' HG3' ' B' ' 132' ' ' MET . 0.5 OUTLIER -51.57 -56.33 14.11 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.417 0.627 . . . . 0.0 111.653 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.604 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 4.7 pttt -70.43 -28.38 64.99 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.476 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . . . -64.72 -26.0 68.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.677 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -87.76 -41.18 13.48 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.98 178.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.558 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 157.18 35.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 177.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.597 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -167.56 96.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 122.149 0.975 . . . . 0.0 113.527 -179.599 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.604 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 34.1 m-80 -67.26 66.23 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.134 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.773 ' CG2' HG21 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 36.34 -6.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -38.36 -61.74 0.66 Allowed 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.569 1.077 . . . . 0.0 111.559 -177.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.83 -33.27 34.2 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.294 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.704 ' CD2' ' HG ' ' A' ' 17' ' ' LEU . 22.4 tp -62.36 -61.97 2.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 117.367 0.584 . . . . 0.0 111.707 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.773 HG21 ' CG2' ' A' ' 24' ' ' ILE . 17.6 t -46.15 -68.54 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 O-C-N 123.381 0.425 . . . . 0.0 110.204 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.578 ' CB ' ' CB ' ' B' ' 112' ' ' ASP . 2.9 m -49.96 -37.01 30.2 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -64.13 -51.41 64.06 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.508 HG22 ' OG1' ' B' ' 131' ' ' THR . 28.2 m -60.99 -39.85 91.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.057 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.821 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 6.0 mmt -58.41 -57.77 11.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.817 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.423 ' HA ' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -52.79 -35.4 56.69 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.998 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.408 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -70.65 -55.87 7.75 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.61 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.622 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -69.75 -17.53 63.44 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 177.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.687 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -75.83 -50.54 14.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -56.49 10.03 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.12 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.872 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.47 -179.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp . . . . . 0 N--CA 1.465 0.325 0 N-CA-C 110.486 -0.19 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.667 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 4.9 tt0 -113.59 116.51 29.62 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.278 0.561 . . . . 0.0 111.753 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.619 ' NH1' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.07 113.92 17.6 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.653 178.34 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.728 HG23 ' CG ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -106.05 122.65 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.755 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.861 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -125.45 123.78 39.99 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.469 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.584 HG12 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.8 104.1 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 173.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.736 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 55.2 p -70.24 89.79 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.826 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.668 HG23 ' CB ' ' B' ' 114' ' ' TYR . 3.5 t -82.75 -131.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.0 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.715 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 22.3 t0 86.34 -3.39 0.73 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -175.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.5 m -137.04 -59.27 0.7 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.514 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.578 ' CB ' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -46.15 -91.6 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.415 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.5 OUTLIER 179.11 36.53 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.528 -0.733 . . . . 0.0 110.63 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.754 ' CD2' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -82.24 -46.16 14.07 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -178.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.528 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.82 -34.73 12.97 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.687 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -59.85 -56.93 15.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.424 0.556 . . . . 0.0 112.288 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.821 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -53.46 -40.61 65.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 119.856 -0.737 . . . . 0.0 111.495 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.658 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -79.15 -26.89 42.72 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 0.0 110.196 178.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -62.03 -29.82 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.738 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -88.0 -44.07 11.27 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.708 178.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.683 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 t0 160.21 15.82 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 177.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.466 ' O ' ' CD2' ' B' ' 117' ' ' LEU . 60.9 t -154.28 93.35 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-N 118.848 0.749 . . . . 0.0 112.938 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.575 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.3 m120 -56.58 -97.64 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.672 HG13 ' HE2' ' A' ' 32' ' ' MET . 0.2 OUTLIER -142.73 -1.28 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.9 OUTLIER -39.27 -64.47 0.46 Allowed 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.202 -177.823 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.22 -26.63 35.99 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 121.1 -0.572 . . . . 0.0 112.449 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.7 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.79 -61.09 2.75 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.065 0.46 . . . . 0.0 110.641 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.736 HG13 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -49.03 -66.38 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.965 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.499 ' N ' HG13 ' B' ' 128' ' ' VAL . 94.9 p -49.27 -35.22 17.23 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 29.0 m -70.76 -53.72 14.43 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.508 ' OG1' HG22 ' A' ' 31' ' ' THR . 0.6 OUTLIER -62.55 -41.0 98.61 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.111 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.766 ' HG3' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -56.72 -51.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.325 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.54 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.81 -39.3 71.16 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 121.024 -0.271 . . . . 0.0 111.09 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -47.46 65.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.562 ' CB ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.99 -27.82 68.42 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.025 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -74.13 -52.33 12.88 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 122.919 0.487 . . . . 0.0 110.607 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -50.49 66.87 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.417 0.627 . . . . 0.0 110.724 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.463 ' CZ ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.77 0 CA-C-N 114.964 -1.016 . . . . 0.0 112.561 -177.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.357 0 CA-C-O 121.111 0.482 . . . . 0.0 111.71 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.582 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 34.4 tp60 -111.36 119.48 38.99 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.742 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.788 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 9.0 ttp-105 -78.17 107.92 11.1 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.327 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.651 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.8 OUTLIER -109.33 116.47 52.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.128 178.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.638 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -121.51 124.03 43.43 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 119.8 -0.76 . . . . 0.0 112.921 -177.414 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.619 HG21 ' HA ' ' B' ' 125' ' ' SER . 0.1 OUTLIER -101.69 108.44 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.492 HG22 ' HG3' ' B' ' 104' ' ' ARG . 11.4 p -70.5 88.73 0.68 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.156 0.503 . . . . 0.0 110.54 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.737 HG23 ' CD1' ' A' ' 14' ' ' TYR . 15.8 m -81.9 -146.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.852 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.673 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 4.3 t70 87.82 -10.97 0.52 Allowed 'General case' 0 C--N 1.353 0.721 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -176.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 t -116.53 -69.84 0.83 Allowed 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.373 177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.748 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -51.68 -86.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.664 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.615 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 0.4 OUTLIER 178.77 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 120.416 1.462 . . . . 0.0 112.997 -178.955 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.831 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -82.96 -41.06 19.25 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.33 0.652 . . . . 0.0 112.615 179.429 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.569 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 1.5 mp0 -49.11 -42.91 40.74 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -175.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.584 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -55.26 -42.71 73.86 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.469 1.031 . . . . 0.0 112.445 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.673 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.37 -55.12 27.08 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.108 -179.079 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -67.77 -26.0 65.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.495 0.664 . . . . 0.0 110.015 178.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -61.45 -31.77 71.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.594 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.666 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.5 -42.52 12.05 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 118.396 -0.811 . . . . 0.0 109.995 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.561 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 152.88 26.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.499 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.428 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.3 t -156.43 91.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 O-C-N 122.106 -0.371 . . . . 0.0 111.904 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.404 ' HB3' HD12 ' A' ' 24' ' ' ILE . 8.7 m-20 -54.78 -92.01 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.685 HG21 HG21 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -153.84 1.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 115.874 1.805 . . . . 0.0 115.874 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.618 ' HA ' HG21 ' B' ' 107' ' ' VAL . 1.3 p -38.97 -63.72 0.51 Allowed 'General case' 0 C--O 1.246 0.915 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.236 -177.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.86 -23.39 52.89 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.443 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.676 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 0.2 OUTLIER -65.12 -60.88 2.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.825 0.313 . . . . 0.0 111.111 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.664 HG22 HG23 ' A' ' 24' ' ' ILE . 15.7 t -50.44 -65.28 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.401 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.653 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 12.9 p -48.62 -36.1 15.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.3 m -78.04 -52.28 9.02 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.51 -41.15 93.75 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.605 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.763 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 6.2 mmt -54.87 -47.02 74.76 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.504 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.4 tt0 -60.46 -52.6 64.5 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.7 0.286 . . . . 0.0 110.805 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -48.1 76.41 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.014 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.8 -33.07 71.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.147 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.526 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -64.56 -45.71 85.89 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.498 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -62.26 -51.33 68.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.332 177.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? . . . . . 0 N--CA 1.448 -0.546 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.429 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.47 ' HB3' HG22 ' A' ' 9' ' ' VAL . 24.9 tt0 -98.67 114.11 26.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.651 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.492 ' HG3' HG22 ' A' ' 8' ' ' THR . 14.7 ttm-85 -78.29 105.35 9.47 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.401 0.619 . . . . 0.0 112.233 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.703 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -106.63 126.4 62.47 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 176.293 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.651 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -124.44 127.81 48.07 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 119.94 -0.704 . . . . 0.0 112.154 -177.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.618 HG21 ' HA ' ' A' ' 25' ' ' SER . 1.2 t -100.14 93.85 3.2 Favored 'Isoleucine or valine' 0 C--N 1.346 0.44 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.788 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 73.3 p -70.62 66.87 0.35 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.811 0.815 . . . . 0.0 109.434 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.705 ' CG2' ' HB2' ' B' ' 112' ' ' ASP . 7.5 p -90.55 -124.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 CA-C-N 113.905 -1.498 . . . . 0.0 108.816 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.582 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 21.7 t70 158.41 -92.22 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.612 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 26.5 t -97.61 9.57 42.16 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.226 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.705 ' HB2' ' CG2' ' B' ' 109' ' ' VAL . 52.8 m-20 -80.37 68.91 6.7 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 117.794 -1.563 . . . . 0.0 108.242 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.712 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 61.97 -24.3 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.167 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.629 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.5 OUTLIER -48.69 -62.36 1.55 Allowed 'General case' 0 C--N 1.348 0.506 0 CA-C-O 120.895 0.379 . . . . 0.0 111.313 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.612 ' HG2' ' HA ' ' B' ' 111' ' ' SER . 0.8 OUTLIER -49.85 -34.56 20.26 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.134 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.2 OUTLIER -59.75 -56.1 26.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.79 ' HG ' ' CE2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER -54.04 -44.46 71.05 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 120.412 -0.515 . . . . 0.0 112.226 -177.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.648 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER -70.57 -25.66 63.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 178.664 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' B' ' 116' ' ' LEU . . . -63.88 -28.02 69.56 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.02 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.79 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -88.35 -41.4 12.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.749 -1.119 . . . . 0.0 110.715 178.726 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.639 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 m-20 146.42 45.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.417 HG22 ' O ' ' B' ' 121' ' ' ASP . 25.7 t -150.9 -43.85 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.648 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 5.2 m-80 73.06 -121.09 0.05 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.681 HG13 ' HE2' ' A' ' 32' ' ' MET . 0.2 OUTLIER -138.3 0.26 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 C-N-CA 119.515 -0.874 . . . . 0.0 113.308 177.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.619 ' HA ' HG21 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.65 -63.14 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.094 0.473 . . . . 0.0 109.784 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.569 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -88.21 -33.98 10.13 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.329 178.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.625 HD22 HD21 ' B' ' 117' ' ' LEU . 9.1 tp -54.65 -62.35 1.71 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 117.149 0.475 . . . . 0.0 111.168 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.724 ' CG1' ' SD ' ' B' ' 132' ' ' MET . 1.9 t -52.07 -62.34 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.313 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.748 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 20.9 p -52.46 -44.31 65.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.569 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -73.22 -49.14 29.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' B' ' 135' ' ' GLU . 2.8 m -53.72 -52.25 60.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.831 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 8.9 mtt -55.37 -53.77 51.98 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.615 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -52.58 -42.59 64.65 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.443 179.519 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -65.64 -54.45 27.48 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 131' ' ' THR . 6.7 mm-40 -60.65 -28.05 68.28 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.584 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -76.02 -50.91 13.51 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.602 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -49.16 62.51 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.964 0.888 . . . . 0.0 109.529 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.402 ' HD3' ' HA ' ' B' ' 138' ' ' ARG . 3.6 mmt180 . . . . . 0 N--CA 1.443 -0.803 0 CA-C-N 113.579 -1.646 . . . . 0.0 113.412 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.502 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 120.463 0.173 . . . . 0.0 110.905 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.2 OUTLIER -123.93 102.12 7.61 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.405 0.622 . . . . 0.0 111.526 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.863 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.9 ttm105 -79.55 111.32 15.7 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.546 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.752 HG21 ' CD2' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -110.26 122.79 65.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.199 179.464 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.678 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.63 131.93 43.61 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.406 -0.918 . . . . 0.0 112.687 -177.788 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.606 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.4 OUTLIER -100.19 112.17 31.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.053 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.488 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 7.0 p -70.85 81.56 0.64 Allowed 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.923 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.671 ' CG2' ' CD2' ' A' ' 14' ' ' TYR . 7.0 m -77.39 -137.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.156 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.69 ' HB2' ' HB2' ' B' ' 103' ' ' GLN . 36.9 t70 84.88 -11.47 0.78 Allowed 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -122.13 -63.11 1.32 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.187 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.622 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 0.8 OUTLIER -48.16 -97.94 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.197 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.574 ' O ' ' HB2' ' B' ' 132' ' ' MET . 4.0 m -174.23 41.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.144 -0.972 . . . . 0.0 111.814 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.687 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -80.6 -41.59 23.7 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.557 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.0 -46.36 43.78 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -175.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.812 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -53.55 -44.82 69.55 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.574 0.625 . . . . 0.0 112.237 -179.351 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.842 HD13 ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -63.5 -48.28 78.25 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.444 0.64 . . . . 0.0 111.626 -179.826 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.565 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -76.93 -29.97 55.9 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.145 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.517 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -29.71 70.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.764 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.638 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.82 -43.71 11.03 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.61 179.012 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.638 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 155.51 37.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.581 ' HB ' ' CD2' ' A' ' 17' ' ' LEU . 47.6 t -150.82 86.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 121.115 -0.991 . . . . 0.0 113.062 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.526 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -76.59 54.38 0.95 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.164 0.506 . . . . 0.0 111.069 179.081 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.665 HG23 ' HE3' ' B' ' 132' ' ' MET . 0.7 OUTLIER 39.55 -4.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 119.339 3.089 . . . . 0.0 119.339 178.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.639 ' HA ' HG21 ' B' ' 107' ' ' VAL . 0.0 OUTLIER -38.69 -63.88 0.48 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 120.267 1.394 . . . . 0.0 110.578 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.502 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.35 -33.38 11.81 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.923 -0.655 . . . . 0.0 111.862 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.585 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 0.2 OUTLIER -52.61 -61.64 2.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.919 0.39 . . . . 0.0 110.764 178.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.707 HG13 ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -53.18 -66.31 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.862 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.633 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 18.5 m -50.97 -41.74 59.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.502 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.46 -54.33 11.0 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.1 m -54.12 -39.3 66.31 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.78 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.785 ' HE2' HG12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.46 -51.31 58.13 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.178 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -48.6 -33.37 9.67 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.992 0.814 . . . . 0.0 110.16 179.69 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.3 -57.18 9.07 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.86 -10.34 59.51 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.603 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HB2' ' HB3' ' B' ' 116' ' ' LEU . . . -88.49 -28.95 20.49 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.11 -54.0 5.64 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.641 0.734 . . . . 0.0 109.708 179.066 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.794 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.188 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' A' ' 8' ' ' THR . 4.3 mmtm . . . . . 0 N--CA 1.463 0.208 0 CA-C-O 120.56 0.219 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.69 ' HB2' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -94.87 113.58 25.33 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.0 0.428 . . . . 0.0 112.012 -179.473 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.585 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.46 97.81 7.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.942 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.63 ' O ' ' HA ' ' A' ' 6' ' ' THR . 8.9 pt -100.04 113.77 36.51 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.958 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.678 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -117.98 119.32 34.43 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.639 HG21 ' HA ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -100.19 102.78 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 174.082 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.863 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 14.3 p -67.97 89.8 0.3 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.909 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.657 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 5.8 t -80.97 -126.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.455 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.642 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 81.65 -10.65 1.14 Allowed 'General case' 0 C--N 1.351 0.648 0 CA-C-N 118.86 0.755 . . . . 0.0 109.188 -176.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.3 m -128.25 -61.88 1.07 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.001 177.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.633 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.18 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -178.374 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.439 ' HB3' ' O ' ' A' ' 29' ' ' SER . 9.6 t -179.57 41.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.185 0.902 . . . . 0.0 111.428 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.752 ' CD2' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -83.68 -50.22 8.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.748 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -49.61 -41.35 41.97 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.787 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.637 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -51.33 -56.43 13.11 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.539 0.609 . . . . 0.0 110.981 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.644 ' HG ' ' HG3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -45.9 -52.68 11.08 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.809 0.814 . . . . 0.0 111.56 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 15.3 pttt -79.43 -30.3 42.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.768 -1.105 . . . . 0.0 111.877 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.537 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -66.52 -22.11 66.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.471 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.634 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.13 -41.99 12.65 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.167 178.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.634 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.1 t70 170.81 25.43 0.0 OUTLIER 'General case' 0 C--N 1.359 0.999 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.546 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.4 OUTLIER -170.29 107.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.064 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.64 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 71.6 m-80 -66.8 50.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.732 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.785 HG12 ' HE2' ' A' ' 32' ' ' MET . 1.9 pp 34.89 2.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 119.409 3.115 . . . . 0.0 119.409 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.44 -62.04 0.63 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.294 0.497 . . . . 0.0 110.689 -178.209 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -77.62 -24.7 64.51 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.645 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.508 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 1.8 tm? -67.67 -57.11 6.96 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.999 0.4 . . . . 0.0 110.774 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.646 ' O ' ' HG2' ' B' ' 132' ' ' MET . 88.3 t -50.19 -73.17 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.895 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.736 ' HA ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.43 -33.89 15.2 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 19.8 m -68.81 -47.36 66.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -59.06 -39.61 82.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.516 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.842 ' SD ' HD13 ' A' ' 17' ' ' LEU . 14.7 mmm -57.54 -57.38 12.93 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.532 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -59.34 -38.11 79.54 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.074 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -68.15 -46.74 69.96 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.879 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -71.2 -28.82 64.5 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.601 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.812 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.96 -25.67 43.51 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.304 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -82.54 -53.45 5.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.812 0.815 . . . . 0.0 110.487 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.777 0 CA-C-N 114.054 -1.43 . . . . 0.0 114.164 -177.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.0 ptpt . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 120.858 0.361 . . . . 0.0 111.617 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.602 ' O ' ' HA ' ' B' ' 108' ' ' THR . 34.5 tp60 -95.9 118.51 32.67 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.211 0.529 . . . . 0.0 110.997 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.732 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.84 105.82 9.28 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.698 0.761 . . . . 0.0 111.584 -178.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.624 HD12 ' CD1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -108.99 111.51 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 177.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -116.49 128.38 55.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.517 -177.424 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.597 HG21 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -98.87 101.51 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 176.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.436 ' CG2' ' NH1' ' B' ' 104' ' ' ARG . 2.3 p -69.72 67.81 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.8 0.81 . . . . 0.0 109.272 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.655 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 9.4 p -79.9 -135.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.384 -178.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.728 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 5.8 t70 91.2 -0.33 0.17 Allowed 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 119.591 1.087 . . . . 0.0 109.165 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.5 -55.98 0.69 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.673 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.732 ' CB ' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -45.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 123.526 0.516 . . . . 0.0 111.579 -179.487 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.534 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 0.3 OUTLIER 176.59 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 119.176 0.898 . . . . 0.0 111.771 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.714 ' CZ ' ' HD3' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -83.39 -43.15 16.21 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -49.83 -39.99 40.68 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.693 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -57.28 -56.6 19.75 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.791 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -54.15 -47.35 72.05 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.021 -0.672 . . . . 0.0 112.268 -177.36 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.714 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 pttt -73.24 -25.76 60.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.301 0.572 . . . . 0.0 110.01 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.439 ' HB1' ' O ' ' A' ' 16' ' ' LEU . . . -64.1 -28.61 69.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.052 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.32 -43.12 11.77 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.305 178.685 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.668 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.6 t70 163.84 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.763 ' HB ' HD23 ' A' ' 17' ' ' LEU . 47.6 t -137.89 89.06 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 119.624 1.102 . . . . 0.0 113.588 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.569 ' O ' HD13 ' A' ' 24' ' ' ILE . 46.6 m-80 -68.93 61.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.946 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.724 ' CG1' ' HE3' ' B' ' 132' ' ' MET . 0.4 OUTLIER 45.41 -16.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 117.871 2.545 . . . . 0.0 117.871 -179.362 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 23' ' ' ASN . 7.8 t -37.61 -64.49 0.38 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.758 1.163 . . . . 0.0 112.013 -176.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.91 -22.45 57.72 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.684 HD11 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -65.81 -62.05 1.72 Allowed 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 122.728 0.411 . . . . 0.0 110.767 179.644 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.61 ' O ' ' HG2' ' A' ' 32' ' ' MET . 5.2 t -48.79 -63.01 0.4 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.98 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.684 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.813 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -48.44 -36.45 14.94 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 25.4 m -69.91 -52.66 22.76 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.6 m -61.23 -39.24 89.55 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.856 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 5.7 mmt -60.06 -57.88 10.94 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.893 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 3.0 tt0 -57.16 -35.22 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -50.41 33.13 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 1.5 tp10 -72.96 -16.34 61.53 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.568 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -86.01 -47.95 9.12 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.815 0.446 . . . . 0.0 110.117 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 1.2 mmt180 -55.58 -52.03 65.12 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.57 0.7 . . . . 0.0 110.77 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 . . . . . 0 N--CA 1.445 -0.688 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.957 -178.214 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.728 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 36.4 tt0 -101.97 114.6 28.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.243 0.544 . . . . 0.0 109.975 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.474 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.9 ttm-85 -79.32 99.93 7.34 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.282 -177.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.626 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -108.1 110.31 31.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -107.15 122.19 46.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.863 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.544 HG12 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.08 95.11 3.76 Favored 'Isoleucine or valine' 0 C--N 1.343 0.285 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.732 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 74.3 p -68.16 94.03 0.48 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.248 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.693 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -80.9 -132.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.925 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 19.9 t70 91.23 -12.53 0.24 Allowed 'General case' 0 C--N 1.351 0.637 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -129.66 -54.27 1.15 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.445 178.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.813 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.7 OUTLIER -48.72 -99.63 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -179.2 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.229 -0.92 . . . . 0.0 110.828 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.693 ' HB3' ' CG2' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.27 -39.14 21.23 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.944 1.091 . . . . 0.0 113.944 -179.062 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.487 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.3 -39.63 22.43 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -175.183 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.568 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -60.89 -56.68 18.27 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.856 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 1.5 mt -57.46 -38.19 74.09 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.318 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.631 ' HD3' ' OH ' ' B' ' 114' ' ' TYR . 0.8 OUTLIER -79.35 -31.23 42.96 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.155 0.503 . . . . 0.0 111.132 178.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.603 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.67 -28.92 67.69 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.364 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.713 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.28 -42.62 12.13 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 117.469 -1.253 . . . . 0.0 110.977 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.713 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 2.7 p30 151.35 12.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.572 HG13 ' N ' ' B' ' 123' ' ' ASN . 1.4 p -89.83 -31.17 5.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 118.882 0.764 . . . . 0.0 112.886 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.572 ' N ' HG13 ' B' ' 122' ' ' VAL . 1.8 m-80 36.04 41.12 0.12 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.028 0.531 . . . . 0.0 111.621 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.777 ' CG2' ' HE3' ' A' ' 32' ' ' MET . 0.5 OUTLIER 43.74 -8.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 N-CA-C 118.494 2.775 . . . . 0.0 118.494 179.438 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.597 ' HA ' HG21 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.87 -63.29 0.54 Allowed 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.114 1.324 . . . . 0.0 110.026 -177.842 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.43 -23.19 54.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.024 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.617 ' HG ' HD12 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.72 -61.05 2.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.521 0.328 . . . . 0.0 111.209 179.892 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.652 ' O ' ' HG2' ' B' ' 132' ' ' MET . 17.2 t -50.13 -63.69 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.459 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.732 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 13.5 p -49.9 -43.83 49.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 23.5 m -68.87 -53.68 19.88 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.502 HG22 ' HA ' ' B' ' 128' ' ' VAL . 2.1 t -56.14 -40.23 73.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.688 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.791 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -62.09 -57.75 10.4 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.282 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.534 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 1.3 tp60 -49.65 -40.9 41.22 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.038 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -69.56 -57.12 5.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.072 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.454 ' HB3' HD13 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -66.81 -14.73 62.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.333 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.693 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.14 -52.79 5.05 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.198 0.599 . . . . 0.0 111.689 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -54.96 -56.32 20.93 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.379 0.609 . . . . 0.0 111.825 -178.711 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.438 -1.066 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.095 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.991 0.424 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' B' ' 108' ' ' THR . 29.3 tp60 -104.2 107.38 18.26 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.219 0.533 . . . . 0.0 110.235 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.753 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.6 ttm180 -78.19 102.87 7.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.72 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.692 ' CD1' HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -108.1 127.19 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 177.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.632 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -129.73 127.77 41.11 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.81 -0.756 . . . . 0.0 112.529 -176.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.51 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -100.57 109.06 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.363 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.404 ' HB ' ' HB2' ' B' ' 102' ' ' LYS . 5.8 p -70.56 94.31 0.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.083 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.692 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 2.8 t -84.6 -132.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.827 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.658 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 3.8 t70 82.63 -10.32 1.07 Allowed 'General case' 0 C--N 1.35 0.627 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.1 m -128.4 -58.18 1.19 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.204 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.812 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 1.3 m-20 -49.7 -101.96 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -177.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 36.02 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.558 -0.714 . . . . 0.0 110.701 -178.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.692 ' HB3' ' CG1' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.01 -39.15 23.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.303 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.633 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.12 -45.52 33.12 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -176.846 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.698 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -54.59 -47.32 73.49 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.943 0.792 . . . . 0.0 111.893 -179.615 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.827 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.82 -49.86 76.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.117 -179.461 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.5 OUTLIER -73.99 -26.06 60.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.299 178.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -65.38 -27.53 68.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.409 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.665 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.1 -42.19 12.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.468 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.665 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.6 21.34 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 176.287 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.605 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 61.7 t -156.71 94.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.597 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.504 ' HB2' HD13 ' A' ' 24' ' ' ILE . 3.3 p30 -60.34 -93.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.775 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -148.61 3.08 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 179.072 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.474 ' O ' HG22 ' B' ' 107' ' ' VAL . 4.1 t -38.03 -63.17 0.5 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.662 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.05 -29.99 18.63 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.507 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.697 ' CD2' ' SD ' ' B' ' 132' ' ' MET . 13.0 tp -56.52 -61.97 2.05 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 117.282 0.541 . . . . 0.0 110.718 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.775 HG23 ' HB ' ' A' ' 24' ' ' ILE . 4.1 t -54.66 -57.09 7.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-O 121.774 0.797 . . . . 0.0 109.097 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.839 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 60.2 m -47.38 -49.84 23.71 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.802 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.5 OUTLIER -80.75 -47.4 13.99 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.78 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.34 -43.83 92.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.69 -179.321 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.783 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 5.6 mmt -54.01 -57.11 12.26 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.319 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.553 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -54.86 -36.97 65.66 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -52.88 22.03 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.55 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 1.6 tp10 -70.78 -25.31 62.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.408 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.734 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -81.88 -25.22 35.21 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 122.839 0.456 . . . . 0.0 110.747 178.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -79.66 -46.99 16.14 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 122.095 0.95 . . . . 0.0 108.835 178.05 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.959 0 CA-C-N 113.233 -1.803 . . . . 0.0 113.172 -177.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 22.7 mmmt . . . . . 0 N--CA 1.466 0.36 0 CA-C-O 120.678 0.275 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.63 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -104.88 107.68 18.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.119 0.485 . . . . 0.0 111.014 179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.481 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.2 OUTLIER -78.59 106.97 10.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.856 0.836 . . . . 0.0 111.875 -178.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.653 HG21 ' CG ' ' A' ' 14' ' ' TYR . 1.4 pt -110.04 120.77 61.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.089 178.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.632 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.01 125.8 32.38 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -177.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.692 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.47 103.84 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.753 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 82.1 p -68.94 90.15 0.43 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.192 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.686 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 2.2 t -79.22 -134.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.296 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.609 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 35.3 t70 90.54 -5.74 0.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.711 0.767 . . . . 0.0 109.192 -176.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -134.61 -59.37 0.81 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.156 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.839 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 1.5 m-20 -47.98 -95.03 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.553 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 1.2 m -177.93 35.0 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.362 -0.836 . . . . 0.0 111.404 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.686 ' HB3' ' CG2' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -80.6 -43.97 19.7 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.645 0.778 . . . . 0.0 111.269 179.302 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 81.8 mt-30 -49.81 -38.29 34.01 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.68 -177.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.734 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -57.27 -56.52 20.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.528 0.603 . . . . 0.0 112.211 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.783 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -54.6 -40.07 68.51 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.733 -178.29 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.24 -32.3 43.79 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.458 0.647 . . . . 0.0 110.938 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.571 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -62.98 -28.88 70.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.611 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.651 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.3 OUTLIER -88.02 -46.28 9.47 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.661 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.651 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 3.2 t0 165.87 12.72 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 72.7 t -153.69 91.99 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-N 118.783 0.719 . . . . 0.0 112.014 -177.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.636 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.0 OUTLIER -59.3 -102.36 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.707 HG22 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.37 4.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 179.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.4 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -44.41 -64.03 0.77 Allowed 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.327 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.463 ' HA2' ' OG ' ' B' ' 129' ' ' SER . . . -86.1 -29.74 24.72 Favored Glycine 0 C--N 1.337 0.631 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.071 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.656 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.4 -61.38 2.37 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 122.342 0.257 . . . . 0.0 110.649 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.685 HG21 ' HB ' ' B' ' 124' ' ' ILE . 2.4 t -54.64 -61.88 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-O 121.347 0.594 . . . . 0.0 110.103 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.812 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 9.0 p -47.99 -44.05 30.32 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -78.65 -47.79 16.34 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.447 0.567 . . . . 0.0 109.972 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.443 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 3.2 m -60.13 -47.69 84.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.322 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.827 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 4.5 mmt -54.64 -53.63 52.28 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.484 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -49.39 -40.11 34.86 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -69.75 -48.99 57.37 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 121.367 -0.133 . . . . 0.0 110.911 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -74.66 -13.57 60.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.914 0.388 . . . . 0.0 110.214 178.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.698 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.75 -48.52 7.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -51.6 -54.53 26.69 Favored 'General case' 0 CA--C 1.5 -0.97 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.266 178.701 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.505 -178.662 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 120.581 0.229 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.589 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 4.2 tt0 -124.23 121.8 36.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.584 0.707 . . . . 0.0 111.771 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.898 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.7 ttp-105 -79.81 113.25 17.82 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.069 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.771 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -103.4 124.35 57.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.65 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.591 ' CG2' ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -129.99 123.61 31.01 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.434 -0.906 . . . . 0.0 111.844 -177.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.662 HG23 HD12 ' B' ' 124' ' ' ILE . 1.2 t -100.67 108.46 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.417 HG22 ' HG3' ' B' ' 104' ' ' ARG . 10.9 p -70.9 89.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.753 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 2.1 t -86.41 -132.31 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 119.106 -0.473 . . . . 0.0 111.985 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.669 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.9 t70 82.4 -8.82 1.21 Allowed 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -175.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -130.1 -63.23 0.91 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.119 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.684 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.72 -89.84 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.772 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.9 t 176.53 39.55 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.705 0.764 . . . . 0.0 110.772 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.872 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -83.71 -44.25 14.67 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.877 -179.251 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -47.53 -37.9 13.04 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -175.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.629 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.83 -56.6 19.27 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.721 0.692 . . . . 0.0 112.458 -179.628 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.895 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.65 -43.87 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.457 0.646 . . . . 0.0 111.378 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.706 ' HB3' ' HB3' ' A' ' 23' ' ' ASN . 4.2 pttt -79.65 -30.95 41.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.605 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.486 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -59.34 -29.05 67.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.873 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.65 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.12 -46.55 9.2 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.463 178.459 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.65 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 154.83 19.72 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 176.125 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.504 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 75.0 t -156.58 84.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 118.165 0.438 . . . . 0.0 111.678 -178.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.706 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -58.08 -96.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.67 HG23 ' HE3' ' B' ' 132' ' ' MET . 0.3 OUTLIER -138.98 -3.71 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 115.664 1.728 . . . . 0.0 115.664 -179.427 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 78.3 p -39.05 -64.23 0.47 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-N 119.057 0.844 . . . . 0.0 109.501 -179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.414 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -85.22 -29.99 26.46 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.65 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.561 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 4.9 tp -58.64 -61.98 2.2 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.875 0.338 . . . . 0.0 110.83 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.609 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.1 t -52.03 -67.25 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.658 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 90.9 p -48.45 -36.76 15.64 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -78.47 -45.93 20.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.556 0.616 . . . . 0.0 109.595 178.427 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.412 ' N ' ' CG2' ' A' ' 30' ' ' THR . 20.9 m -64.0 -50.02 70.18 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.65 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.752 ' HE3' ' CG2' ' B' ' 124' ' ' ILE . 2.6 mmt -50.96 -43.13 60.33 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.849 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.434 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -61.21 -48.92 79.27 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -47.47 85.4 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.566 ' CB ' HD23 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -64.75 -38.63 91.64 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.57 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -59.11 -47.27 85.87 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -51.91 67.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 . . . . . 0 N--CA 1.449 -0.508 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.925 -179.551 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 5.3 mmpt? . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 120.434 0.159 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 9' ' ' VAL . 26.9 tp60 -114.01 115.25 27.32 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.942 0.401 . . . . 0.0 111.887 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.426 ' HG3' ' NH1' ' B' ' 104' ' ' ARG . 5.9 ttm-85 -78.42 109.18 12.35 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.876 0.846 . . . . 0.0 111.773 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.652 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.8 OUTLIER -108.16 127.31 64.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 113.993 -1.458 . . . . 0.0 107.115 177.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.591 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.46 129.86 41.73 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -177.301 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.559 ' O ' HG21 ' A' ' 5' ' ' ILE . 1.1 m -101.57 99.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 173.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.898 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -70.76 67.48 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.793 -0.763 . . . . 0.0 111.782 -177.695 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.632 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 3.8 m -99.67 -114.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.589 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 10.0 t0 145.74 -84.82 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -88.19 2.84 51.3 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.134 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.658 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -76.14 62.26 1.68 Allowed 'General case' 0 C--N 1.357 0.93 0 CA-C-N 119.588 1.085 . . . . 0.0 108.73 179.419 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.622 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 59.55 -25.58 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.755 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.771 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -44.49 -62.19 1.27 Allowed 'General case' 0 C--N 1.348 0.534 0 C-N-CA 123.352 0.661 . . . . 0.0 111.411 -179.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.576 ' N ' ' CG ' ' B' ' 114' ' ' TYR . 2.6 pp0? -49.45 -33.59 14.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.58 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.447 ' HA ' ' HB3' ' B' ' 119' ' ' ALA . 0.2 OUTLIER -60.4 -50.18 74.61 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.709 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -52.53 -51.97 57.05 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.695 0.759 . . . . 0.0 111.557 -179.571 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.637 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -73.47 -29.02 62.26 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.193 179.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.447 ' HB3' ' HA ' ' B' ' 116' ' ' LEU . . . -64.54 -25.72 68.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.607 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.3 OUTLIER -87.78 -41.0 13.59 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 118.608 -0.711 . . . . 0.0 109.804 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 158.68 39.04 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 177.057 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.61 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.1 94.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.637 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 59.1 m-80 -67.3 71.01 0.11 Allowed 'General case' 0 N--CA 1.462 0.128 0 O-C-N 121.599 -0.688 . . . . 0.0 109.584 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.752 ' CG2' ' HE3' ' A' ' 32' ' ' MET . 0.3 OUTLIER 37.59 -10.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.572 ' HA ' ' CG2' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.84 -55.99 1.14 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 120.002 1.274 . . . . 0.0 110.52 -176.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.533 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.16 -30.42 28.31 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.311 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.609 HD11 ' SD ' ' A' ' 32' ' ' MET . 1.7 tm? -60.88 -61.26 2.71 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.952 0.376 . . . . 0.0 110.687 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.587 HG21 ' HB ' ' B' ' 124' ' ' ILE . 41.4 t -50.68 -64.19 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.684 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 24.7 p -50.42 -48.7 56.08 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.533 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -62.92 -50.92 68.94 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 23.4 m -58.01 -42.69 85.78 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.06 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.895 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -59.19 -57.26 13.82 Favored 'General case' 0 C--O 1.209 -1.071 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.403 179.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.9 OUTLIER -49.1 -41.67 36.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.606 179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -51.91 54.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.602 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.647 ' HB3' HD21 ' A' ' 17' ' ' LEU . 8.9 tp10 -74.73 -14.57 60.74 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.684 0.278 . . . . 0.0 110.613 178.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.629 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.63 -38.02 16.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 123.211 0.604 . . . . 0.0 110.994 179.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -71.84 -53.45 13.24 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.835 0.826 . . . . 0.0 110.312 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.046 0 CA-C-N 113.969 -1.469 . . . . 0.0 113.62 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.568 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 20.7 mmtm . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.655 0.264 . . . . 0.0 110.746 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.62 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -112.85 114.54 27.11 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 120.927 0.394 . . . . 0.0 111.449 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.902 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.49 104.67 10.26 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.156 -0.618 . . . . 0.0 110.824 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.668 ' CD1' ' CD1' ' B' ' 114' ' ' TYR . 1.4 pt -109.41 127.92 65.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.842 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.9 141.74 48.54 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 117.955 -1.498 . . . . 0.0 113.316 -178.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.71 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.41 102.39 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.525 -1.216 . . . . 0.0 109.16 177.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.655 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -70.18 76.92 0.52 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.707 HG12 ' CB ' ' A' ' 14' ' ' TYR . 9.2 p -110.67 -128.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.907 -176.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.767 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 5.3 t70 94.76 23.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 122.841 1.305 . . . . 0.0 109.399 -175.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -150.24 -50.47 0.13 Allowed 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 112.746 -2.025 . . . . 0.0 110.486 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.703 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 5.6 m-20 -79.16 46.3 0.7 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.485 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 68.9 m 66.82 9.77 7.03 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.781 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -60.75 -50.74 72.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.969 1.258 . . . . 0.0 111.001 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.664 ' HA ' ' HE3' ' A' ' 18' ' ' LYS . 14.3 mm-40 -48.95 -32.46 9.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -56.49 13.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.755 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.29 -56.08 8.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.275 0.559 . . . . 0.0 112.187 -178.306 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.664 ' HE3' ' HA ' ' A' ' 15' ' ' GLN . 5.1 pttp -69.21 -25.98 64.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.491 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.507 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -69.13 -26.74 65.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.07 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.538 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -87.54 -38.57 15.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.725 -0.655 . . . . 0.0 109.664 178.812 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 156.69 25.04 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 177.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.517 ' O ' ' N ' ' A' ' 24' ' ' ILE . 54.4 t -147.89 82.87 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.594 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 3.0 m-20 -64.65 63.79 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.939 0.4 . . . . 0.0 110.593 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.803 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 0.4 OUTLIER 40.96 -13.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 23' ' ' ASN . 10.1 t -38.25 -61.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 119.862 1.21 . . . . 0.0 110.337 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.427 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -78.89 -36.13 29.38 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.031 178.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.522 HD21 ' HG ' ' A' ' 17' ' ' LEU . 7.9 tp -56.58 -61.87 2.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.766 0.317 . . . . 0.0 110.183 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.755 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.7 t -50.21 -64.52 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.176 178.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.676 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 26.5 p -49.36 -45.34 45.69 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -70.06 -42.94 72.17 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.567 ' OG1' HG21 ' B' ' 131' ' ' THR . 35.2 m -61.49 -42.78 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.038 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.81 ' CE ' HG12 ' B' ' 124' ' ' ILE . 1.4 mmt -50.27 -50.67 49.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.502 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.42 -45.15 95.52 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.145 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.74 -52.59 59.79 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.722 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.617 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 0.0 OUTLIER -61.61 -37.1 82.7 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.154 178.714 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.45 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -66.23 -38.94 89.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.704 178.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -73.2 -56.1 5.56 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.397 0.618 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.89 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.183 -177.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 120.557 0.218 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.767 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 2.9 tt0 -122.49 119.88 32.24 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.076 0.465 . . . . 0.0 111.725 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.683 ' CG ' ' OG1' ' A' ' 6' ' ' THR . 9.9 ttt85 -79.64 117.95 21.02 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.795 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.705 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -111.07 116.64 53.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.741 -179.656 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.842 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.11 126.06 54.21 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -176.26 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.512 ' O ' ' CG2' ' B' ' 107' ' ' VAL . 0.2 OUTLIER -100.86 85.78 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 175.425 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.902 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -56.03 98.39 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -179.655 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.67 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 14.9 p -110.36 -137.75 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.562 -175.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.62 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 31.1 t70 89.14 -7.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -174.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.429 ' OG ' ' NZ ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -120.61 -65.51 1.14 Allowed 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.313 -1.312 . . . . 0.0 107.912 176.892 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.676 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -38.72 -84.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.244 0.34 . . . . 0.0 111.26 179.621 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.3 OUTLIER 173.9 45.86 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 121.123 0.487 . . . . 0.0 110.937 179.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.81 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.7 OUTLIER -83.35 -40.86 18.89 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.588 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.82 -40.59 21.54 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.707 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 36' ' ' ALA . 1.4 mt -50.33 -33.48 20.38 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.3 OUTLIER -78.4 -51.11 10.54 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.522 0.677 . . . . 0.0 111.648 178.705 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.616 ' HG2' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -70.46 -25.88 63.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.459 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.45 -27.85 50.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.019 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.542 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 2.8 m-30 -88.47 -40.75 13.23 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.303 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.3 t0 115.31 57.74 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.155 0.978 . . . . 0.0 111.547 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.483 ' HB ' HD11 ' B' ' 117' ' ' LEU . 92.0 t -118.34 -19.86 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.043 -179.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.44 ' O ' HD13 ' B' ' 124' ' ' ILE . 36.0 m-20 41.38 23.25 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.799 0.333 . . . . 0.0 111.562 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.81 HG12 ' CE ' ' A' ' 32' ' ' MET . 2.4 pp 21.99 45.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 177.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.71 ' HA ' HG23 ' A' ' 7' ' ' VAL . 13.3 p -62.97 -63.72 1.12 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.813 176.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.443 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -81.15 -16.56 74.11 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.769 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.617 ' CD1' ' HG2' ' A' ' 35' ' ' GLU . 1.9 tp -66.82 -52.91 38.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.73 0.265 . . . . 0.0 111.235 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.736 ' O ' ' HG2' ' B' ' 132' ' ' MET . 35.0 t -53.57 -67.69 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.703 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 4.6 p -50.8 -36.64 38.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -63.06 -51.68 65.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.567 HG21 ' OG1' ' A' ' 31' ' ' THR . 18.8 m -58.22 -31.73 67.63 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.081 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.803 ' HE3' ' CG2' ' A' ' 24' ' ' ILE . 5.4 mmt -65.54 -54.71 24.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.482 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.407 ' HA ' ' HB1' ' B' ' 136' ' ' ALA . 9.7 tt0 -49.94 -41.53 46.56 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.19 -54.0 44.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 116.833 -0.167 . . . . 0.0 110.749 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -75.08 -8.84 57.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.551 178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.465 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -79.47 -47.31 15.85 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.224 -1.399 . . . . 0.0 107.224 176.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.9 74.54 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.398 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 . . . . . 0 CA--C 1.542 0.651 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.219 -178.582 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 121.093 0.473 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' B' ' 109' ' ' VAL . 1.2 tt0 -95.89 106.56 18.72 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.446 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.799 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.7 OUTLIER -78.87 99.86 6.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.738 -179.486 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.675 HG23 ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -102.96 110.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 177.426 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.668 ' CG2' ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.5 123.65 47.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 -175.645 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.519 ' O ' HG22 ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.16 105.66 17.96 Favored 'Isoleucine or valine' 0 C--N 1.344 0.337 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 176.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.596 HG21 ' HG3' ' B' ' 104' ' ' ARG . 2.0 p -70.08 90.46 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.725 HG22 ' CB ' ' A' ' 14' ' ' TYR . 9.1 t -78.08 -125.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.754 -177.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.561 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.6 t70 86.28 -5.34 0.76 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.292 0.568 . . . . 0.0 110.316 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.8 t -144.92 -52.0 0.28 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.335 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.755 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -44.78 -90.89 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.623 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m 177.85 34.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.392 -0.818 . . . . 0.0 111.133 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.725 ' CB ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -84.05 -46.1 12.36 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.032 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.12 -42.28 28.79 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.977 -176.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.588 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -60.29 -57.92 10.73 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.556 0.616 . . . . 0.0 111.82 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.765 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -60.34 -35.76 76.4 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.633 -178.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.74 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.74 -32.13 41.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.373 0.606 . . . . 0.0 112.117 -179.522 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.622 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -82.1 -16.88 48.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.267 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.553 ' CD1' ' HB2' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -87.98 -33.32 18.45 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.212 179.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.553 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 172.88 -19.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.74 ' O ' ' HA ' ' A' ' 18' ' ' LYS . 17.0 t -97.19 -179.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.255 0.55 . . . . 0.0 110.168 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.589 ' O ' HD12 ' A' ' 24' ' ' ILE . 20.8 m120 -160.67 43.94 0.19 Allowed 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 177.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.687 ' CG2' ' HE2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 46.96 -4.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 113.022 -1.899 . . . . 0.0 115.921 -177.45 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.499 ' H ' ' C ' ' A' ' 23' ' ' ASN . 1.4 t -39.02 -63.79 0.5 Allowed 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.09 0.859 . . . . 0.0 109.675 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.554 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -86.76 -25.36 35.39 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.941 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.761 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -59.49 -62.36 1.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.438 0.619 . . . . 0.0 110.279 179.623 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.602 ' CG1' ' HE1' ' A' ' 32' ' ' MET . 16.2 t -50.59 -59.26 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.787 0.804 . . . . 0.0 109.383 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.739 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 1.4 t -50.12 -52.58 33.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.0 OUTLIER -74.14 -50.96 17.12 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 117.762 0.255 . . . . 0.0 110.435 -177.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.552 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -54.17 -49.16 69.93 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.916 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.892 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 14.9 mtt -54.77 -48.16 73.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.189 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -45.35 73.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.413 0.149 . . . . 0.0 110.778 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -61.93 -57.1 13.03 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.27 -33.61 69.6 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.692 178.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.581 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -70.41 -48.81 54.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.519 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -52.63 64.78 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.369 0.604 . . . . 0.0 111.135 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.698 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.918 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.53 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 18.4 mttm . . . . . 0 CA--C 1.534 0.364 0 CA-C-O 120.603 0.24 . . . . 0.0 111.637 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.561 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 43.5 tp60 -124.45 123.41 40.1 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.653 0.263 . . . . 0.0 110.99 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.596 ' HG3' HG21 ' A' ' 8' ' ' THR . 5.8 ttm105 -85.92 116.45 24.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.354 0.597 . . . . 0.0 111.949 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.678 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -114.45 125.78 71.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 177.296 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.668 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.04 125.72 33.99 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.373 -0.531 . . . . 0.0 112.354 -176.728 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 24' ' ' ILE . 0.9 OUTLIER -102.65 98.46 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 175.19 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.799 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 76.5 p -70.27 93.42 0.84 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.523 0.678 . . . . 0.0 110.816 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.714 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 1.9 t -85.55 -141.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.008 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.515 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.0 t0 91.01 -9.69 0.28 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 5.2 m -129.03 -56.63 1.18 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.196 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.739 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 1.2 m-20 -54.68 -104.19 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -167.14 29.24 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.018 -1.051 . . . . 0.0 111.661 -179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.852 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -72.73 -38.7 67.35 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.647 1.179 . . . . 0.0 112.864 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.607 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.99 -42.27 37.29 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -175.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.581 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -56.37 -34.55 66.76 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.35 0.977 . . . . 0.0 112.857 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.892 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -70.93 -52.36 20.42 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.97 0.414 . . . . 0.0 110.68 179.528 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.86 -25.69 66.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.446 0.641 . . . . 0.0 109.467 177.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -64.08 -33.25 75.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.957 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.592 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -87.99 -29.03 21.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.925 -0.56 . . . . 0.0 110.446 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.0 t0 123.58 71.26 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.488 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 0.3 OUTLIER -169.39 -40.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.483 ' HB3' HD13 ' B' ' 124' ' ' ILE . 14.8 m-80 64.47 -106.95 0.16 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.628 HG22 ' HE2' ' A' ' 32' ' ' MET . 0.2 OUTLIER -153.09 1.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 178.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.3 OUTLIER -39.47 -63.76 0.53 Allowed 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.721 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.38 -29.88 23.57 Favored Glycine 0 CA--C 1.522 0.515 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.945 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.527 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 0.0 OUTLIER -56.88 -60.53 3.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.453 0.301 . . . . 0.0 110.813 179.187 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.641 HG21 HG23 ' A' ' 24' ' ' ILE . 2.3 t -53.55 -64.86 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.755 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 12.8 p -49.21 -43.96 42.84 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.8 m -72.18 -48.8 40.57 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.23 -36.87 85.07 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.025 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.765 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 3.7 mmt -64.42 -54.64 29.56 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.946 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.494 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -48.47 -35.67 13.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.806 -179.595 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -66.35 -57.26 7.83 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.08 -13.05 61.12 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.478 0.18 . . . . 0.0 111.189 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.588 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.84 -30.3 20.29 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 121.086 0.47 . . . . 0.0 109.807 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -82.29 -48.26 11.42 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.71 0.767 . . . . 0.0 110.686 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.674 0 CA-C-N 114.028 -1.442 . . . . 0.0 114.095 -177.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.498 ' O ' ' HA ' ' B' ' 108' ' ' THR . 60.8 tp60 -108.79 111.15 22.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.311 0.577 . . . . 0.0 112.095 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.744 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.0 ttm-85 -79.36 103.6 9.4 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.64 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.753 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.4 OUTLIER -98.1 130.34 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.066 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.076 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.749 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -131.32 130.07 42.27 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 117.799 -1.561 . . . . 0.0 114.191 -177.745 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.742 ' HB ' HG21 ' B' ' 105' ' ' ILE . 0.9 OUTLIER -100.63 108.05 22.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.191 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.076 177.303 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.16 87.5 0.79 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.806 0.813 . . . . 0.0 109.477 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.716 ' CG2' ' CD2' ' A' ' 14' ' ' TYR . 4.7 m -71.43 -155.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.271 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.654 ' CB ' ' HA ' ' B' ' 102' ' ' LYS . 22.3 t70 91.24 -19.04 0.14 Allowed 'General case' 0 C--N 1.35 0.626 0 C-N-CA 123.689 0.795 . . . . 0.0 109.783 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 4.3 m -110.26 -69.6 0.86 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.852 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.653 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -51.69 -88.71 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.573 ' CB ' ' CB ' ' B' ' 133' ' ' GLN . 1.3 m 175.29 46.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.323 0.965 . . . . 0.0 111.874 -178.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.77 ' CE1' ' CG1' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -82.44 -44.72 15.69 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -179.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.468 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 61.5 mt-30 -47.99 -38.43 16.96 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -175.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.681 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.0 OUTLIER -61.38 -57.38 12.51 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.746 0.703 . . . . 0.0 112.669 -179.718 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.79 ' CB ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -47.31 -48.84 25.04 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.431 0.634 . . . . 0.0 112.128 -178.053 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.578 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 2.9 pttt -78.98 -29.39 43.79 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.262 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.511 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -64.94 -27.46 68.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.715 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.619 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.33 -43.06 11.8 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.667 -0.683 . . . . 0.0 110.445 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.5 t70 168.98 15.3 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.533 ' CG1' ' HB2' ' A' ' 27' ' ' LEU . 65.7 t -142.4 84.75 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -177.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.578 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -71.77 51.47 0.2 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.206 0.526 . . . . 0.0 110.852 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.787 ' CG2' ' HE1' ' B' ' 132' ' ' MET . 0.9 OUTLIER 40.9 -8.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 118.97 2.952 . . . . 0.0 118.97 179.479 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -38.52 -63.24 0.52 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-N 119.99 1.268 . . . . 0.0 110.439 -179.022 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.1 -28.44 34.08 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.549 178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.599 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 11.3 tp -63.3 -62.19 1.85 Allowed 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.717 0.259 . . . . 0.0 110.692 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.761 HG21 ' CG2' ' B' ' 128' ' ' VAL . 2.3 t -45.65 -64.61 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 O-C-N 123.373 0.421 . . . . 0.0 110.426 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.62 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 4.8 p -49.18 -35.26 16.51 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 123.136 0.273 . . . . 0.0 111.57 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -69.95 -52.15 26.82 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 86.0 m -55.89 -39.02 70.95 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.293 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.858 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.84 -55.51 29.54 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.695 179.198 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -44.87 87.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.103 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.1 -50.82 62.75 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.184 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 31' ' ' THR . 0.2 OUTLIER -65.64 -33.88 76.91 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.137 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.514 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -61.28 -45.09 95.93 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.77 -51.94 55.03 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.839 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.456 ' HD2' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.544 0 CA-C-N 114.055 -1.429 . . . . 0.0 113.531 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.654 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 10.0 mmtt . . . . . 0 N--CA 1.467 0.378 0 CA-C-O 120.562 0.22 . . . . 0.0 111.267 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.609 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 16.6 tp60 -121.19 125.8 48.08 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 121.66 0.743 . . . . 0.0 111.609 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.411 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 1.7 ttm180 -83.81 116.62 22.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.317 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.77 ' CG1' ' CE1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -94.53 123.48 46.66 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.313 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.624 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -131.07 111.93 12.44 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.482 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.445 HG12 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.56 98.25 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 175.783 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.744 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 72.1 p -68.25 93.44 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.842 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.671 ' O ' ' HB3' ' B' ' 110' ' ' ASP . 6.3 t -80.57 -125.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.143 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.671 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.6 t70 83.21 -15.22 0.66 Allowed 'General case' 0 C--N 1.349 0.557 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -176.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.11 -59.25 1.42 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.997 177.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.62 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.2 m-20 -46.24 -98.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' MET . 24.9 t -175.6 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.461 -0.774 . . . . 0.0 110.504 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.858 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.0 OUTLIER -81.63 -46.58 14.17 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.014 0.926 . . . . 0.0 113.406 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.507 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.94 -40.78 31.54 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.797 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.66 -25.35 17.66 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.661 0.664 . . . . 0.0 112.385 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.585 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.11 -60.43 2.37 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.711 0.767 . . . . 0.0 110.269 178.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.722 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.7 pttt -62.4 -25.11 67.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.19 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.64 -23.93 19.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.18 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.564 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 65.9 m-85 -87.52 -50.98 6.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.564 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 24.0 t0 136.83 54.52 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 O-C-N 124.726 1.266 . . . . 0.0 109.913 179.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.534 HG12 ' CD1' ' B' ' 117' ' ' LEU . 7.1 p -154.1 87.1 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.095 -178.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.559 ' O ' ' N ' ' B' ' 125' ' ' SER . 0.0 OUTLIER -70.55 52.9 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.774 HG12 ' CE ' ' A' ' 32' ' ' MET . 1.3 pp 29.08 10.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 119.433 3.123 . . . . 0.0 119.433 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.672 ' HA ' HG22 ' A' ' 7' ' ' VAL . 3.2 p -37.24 -60.91 0.62 Allowed 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 122.765 0.426 . . . . 0.0 110.891 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.67 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.95 -19.55 61.05 Favored Glycine 0 C--O 1.222 -0.644 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.279 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.572 ' HB3' HG23 ' B' ' 124' ' ' ILE . 2.7 tm? -67.36 -56.44 9.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 117.151 0.476 . . . . 0.0 110.745 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.761 ' CG2' HG21 ' A' ' 28' ' ' VAL . 95.5 t -59.06 -68.65 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 120.951 0.405 . . . . 0.0 110.157 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.653 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 56.3 p -50.32 -38.24 40.66 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.67 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -82.57 -50.02 9.25 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.177 1.353 . . . . 0.0 111.413 -179.286 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -51.43 -31.44 22.97 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.973 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.79 ' SD ' ' CB ' ' A' ' 17' ' ' LEU . 2.1 mmt -61.3 -50.57 72.44 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.227 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.573 ' CB ' ' CB ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -49.94 -40.32 43.24 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.518 0.599 . . . . 0.0 111.171 179.4 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -68.18 -49.41 61.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -77.28 -18.94 57.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.862 0.363 . . . . 0.0 110.532 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.681 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -75.21 -34.97 61.53 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -56.14 4.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 121.785 0.802 . . . . 0.0 109.516 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.915 0 CA-C-N 114.016 -1.447 . . . . 0.0 114.781 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 5.2 mtmt . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.581 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.674 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 20.1 tp60 -118.46 113.78 21.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.029 0.442 . . . . 0.0 111.08 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.808 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.96 107.98 13.17 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.746 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.677 HG13 ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.78 128.05 69.69 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.772 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -127.87 136.26 51.16 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.53 -177.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.533 HG11 HD11 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.65 106.89 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.326 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 3.2 p -70.37 91.74 0.77 Allowed 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.721 -0.392 . . . . 0.0 109.957 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.647 HG22 ' CB ' ' A' ' 14' ' ' TYR . 2.3 t -85.39 -139.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.112 -178.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.481 ' H ' ' CG1' ' A' ' 9' ' ' VAL . 24.8 t0 92.32 -10.4 0.2 Allowed 'General case' 0 C--N 1.35 0.606 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -175.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 m -129.67 -54.06 1.15 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.06 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.727 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -48.1 -99.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.484 ' N ' ' HB2' ' B' ' 129' ' ' SER . 0.2 OUTLIER -176.28 37.64 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.32 -0.863 . . . . 0.0 110.734 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.883 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -82.75 -35.27 26.76 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.368 1.067 . . . . 0.0 113.786 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.494 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.95 -46.25 43.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.532 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -50.64 -33.32 21.9 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.88 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 2.2 mt -74.52 -60.07 2.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.361 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.98 -26.29 68.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.716 0.77 . . . . 0.0 109.815 178.384 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -31.61 72.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.883 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.648 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.24 -38.73 15.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.331 179.491 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 29.8 t70 146.83 31.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.553 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 54.6 t -161.61 99.85 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 O-C-N 122.254 -0.279 . . . . 0.0 111.071 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.495 ' HB3' HD11 ' A' ' 24' ' ' ILE . 42.3 m-80 -54.3 -88.34 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.677 ' CG2' ' HE2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -161.4 7.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.5 p -38.72 -62.74 0.58 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.551 0.614 . . . . 0.0 110.748 -177.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.4 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -84.18 -30.52 28.0 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.722 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.62 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 1.1 tm? -59.8 -59.91 4.68 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.782 0.291 . . . . 0.0 110.769 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.644 ' O ' ' HG2' ' A' ' 32' ' ' MET . 3.8 t -49.71 -65.4 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.902 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -49.22 -41.06 36.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.3 m -67.69 -54.08 22.43 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.415 ' OG1' HG22 ' B' ' 131' ' ' THR . 0.4 OUTLIER -61.99 -40.01 94.16 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.088 -179.454 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.834 ' HE1' ' CG1' ' B' ' 124' ' ' ILE . 3.5 mmt -57.97 -58.05 10.1 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.677 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.1 OUTLIER -51.86 -37.91 53.97 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.118 0.417 . . . . 0.0 111.398 179.804 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.04 -55.38 7.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.813 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -21.47 64.8 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.047 0.451 . . . . 0.0 109.81 178.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.702 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.44 -49.18 28.26 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -51.12 69.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.769 0.795 . . . . 0.0 109.324 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.741 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.173 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 9.3 mmtm . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 121.003 0.43 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.598 ' OE1' HG22 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -95.98 114.88 26.64 Favored 'General case' 0 CA--C 1.495 -1.157 0 CA-C-O 121.094 0.473 . . . . 0.0 111.979 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.656 ' CZ ' HG23 ' A' ' 6' ' ' THR . 7.4 ttt-85 -79.31 98.97 6.89 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.658 -0.817 . . . . 0.0 108.998 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.63 HG23 ' CG ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -99.02 110.69 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.772 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -116.25 120.4 38.84 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.127 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.67 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.19 109.56 25.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 174.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.808 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.1 p -70.28 80.38 0.53 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.698 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 8.4 p -87.97 -140.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.358 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.674 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 3.3 t70 86.44 -3.9 0.72 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 122.103 0.954 . . . . 0.0 108.854 -175.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.32 -64.91 1.09 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.152 177.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.742 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -44.48 -85.85 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.038 -179.212 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.613 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 2.2 m 176.38 39.51 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 119.011 0.823 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.698 ' HB3' ' CG2' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.58 -43.22 15.91 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.598 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.8 OUTLIER -47.65 -39.26 16.65 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -174.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.702 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.7 -56.04 26.78 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.444 1.02 . . . . 0.0 111.734 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.812 ' CB ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -52.11 -43.56 64.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.998 -178.326 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.616 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -79.26 -31.97 43.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.492 179.007 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' B' ' 115' ' ' GLN . . . -57.3 -30.21 64.55 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.493 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.652 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.45 -46.26 9.28 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 118.366 -0.826 . . . . 0.0 109.731 178.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 155.95 32.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.411 HG11 HD12 ' B' ' 117' ' ' LEU . 46.4 t -145.88 84.53 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.544 ' O ' HD12 ' B' ' 124' ' ' ILE . 53.4 m-80 -68.95 61.22 0.1 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.076 0.465 . . . . 0.0 110.887 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.834 ' CG1' ' HE1' ' A' ' 32' ' ' MET . 0.7 OUTLIER 42.57 -6.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -179.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.486 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.88 -62.86 0.58 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.789 1.177 . . . . 0.0 110.274 -179.008 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.05 -29.7 24.96 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.482 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.692 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -59.22 -61.16 2.84 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.827 0.451 . . . . 0.0 110.233 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.621 HG21 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -49.64 -59.23 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.563 179.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.727 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.0 p -50.0 -39.77 42.36 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 52.2 m -70.14 -50.35 41.36 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.415 HG22 ' OG1' ' A' ' 31' ' ' THR . 6.8 m -61.63 -43.73 98.31 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.086 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.883 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.0 mtt -59.54 -57.5 12.68 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.104 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -42.86 71.31 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.163 0.289 . . . . 0.0 111.393 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -66.76 -53.08 36.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.561 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -64.07 -32.67 74.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.532 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -68.05 -50.9 52.41 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.272 0.629 . . . . 0.0 111.18 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -52.39 63.83 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 . . . . . 0 CA--C 1.541 0.606 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.458 179.307 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.515 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 44.2 tp60 -123.67 118.44 27.26 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.372 0.606 . . . . 0.0 112.057 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.829 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.04 115.28 18.61 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.308 179.191 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.71 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.7 OUTLIER -110.18 123.24 65.91 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.644 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.31 126.03 34.29 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.579 -177.017 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.559 HG13 ' CD1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -102.13 107.15 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 3.5 p -70.86 89.38 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.143 0.497 . . . . 0.0 110.864 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.741 HG22 ' CD1' ' A' ' 14' ' ' TYR . 10.9 m -83.25 -150.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.808 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.555 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 25.5 t0 94.82 -7.87 0.11 Allowed 'General case' 0 C--N 1.348 0.519 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -127.98 -59.6 1.18 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.466 -1.243 . . . . 0.0 108.854 176.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.688 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.16 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.41 38.35 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.288 0.949 . . . . 0.0 111.107 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.802 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -81.98 -44.88 16.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.171 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.55 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 13.1 mt-30 -49.24 -43.72 42.97 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.65 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -53.25 -30.97 41.19 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 118.589 0.632 . . . . 0.0 112.132 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.864 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 1.7 mt -77.78 -51.77 9.99 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.988 0.423 . . . . 0.0 111.69 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.666 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -65.79 -25.35 67.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.411 0.624 . . . . 0.0 110.199 178.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.55 -31.02 55.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.747 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.57 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 46.1 m-85 -88.63 -39.82 13.78 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.22 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.2 t70 118.33 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.474 1.13 . . . . 0.0 110.149 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.6 t -130.59 -47.5 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.156 0 CA-C-N 113.979 -1.464 . . . . 0.0 109.46 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.8 m120 58.3 -113.86 0.73 Allowed 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.111 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.714 HG21 HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.0 -0.45 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 115.872 1.805 . . . . 0.0 115.872 -179.556 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 24' ' ' ILE . 9.2 t -39.78 -64.44 0.49 Allowed 'General case' 0 C--O 1.24 0.59 0 C-N-CA 119.575 -0.85 . . . . 0.0 109.968 -178.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.472 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -81.45 -27.06 49.39 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.245 178.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.672 HD22 ' CD1' ' A' ' 17' ' ' LEU . 5.3 tp -62.5 -61.52 2.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.768 0.284 . . . . 0.0 111.008 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.696 HG22 ' HB ' ' A' ' 24' ' ' ILE . 3.7 t -51.83 -70.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.748 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 38.5 p -47.68 -42.53 25.02 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.472 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -74.57 -45.64 44.08 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 119.032 0.833 . . . . 0.0 109.778 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.473 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -68.47 -27.92 66.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.568 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.869 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.5 mmt -57.08 -55.63 32.22 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.368 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.458 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.63 -53.34 53.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.03 0.443 . . . . 0.0 110.42 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.458 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 1.9 m-20 -57.28 -50.83 71.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.049 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.561 ' HG3' HD23 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -68.43 -30.27 69.11 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.13 0.491 . . . . 0.0 109.874 177.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.666 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -67.04 -43.26 83.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.065 0.459 . . . . 0.0 110.374 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.457 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -78.91 -54.67 5.82 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.273 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 tpp180 . . . . . 0 N--CA 1.444 -0.741 0 CA-C-N 114.662 -1.154 . . . . 0.0 114.039 -176.462 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.478 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.563 0 CA-C-O 120.843 0.354 . . . . 0.0 111.064 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.476 ' HB3' HG21 ' A' ' 9' ' ' VAL . 7.8 tt0 -107.03 109.17 20.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.348 0.594 . . . . 0.0 111.45 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.443 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 5.7 ttm180 -78.54 104.82 9.39 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.787 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.641 HG22 ' CD2' ' A' ' 14' ' ' TYR . 5.3 pt -104.94 126.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.647 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -130.58 124.54 32.01 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 119.618 -0.833 . . . . 0.0 112.859 -177.608 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.572 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.94 103.95 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 173.973 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.829 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 15.9 p -66.24 93.06 0.2 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.921 0.391 . . . . 0.0 110.673 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.645 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 1.4 t -96.49 -135.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.596 -178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 5.4 t70 101.06 12.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 122.623 1.201 . . . . 0.0 108.615 -175.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 44.8 m -159.65 -48.23 0.05 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.065 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.748 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -69.59 50.62 0.1 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.559 ' O ' ' HB3' ' A' ' 32' ' ' MET . 0.1 OUTLIER 57.9 3.05 0.2 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 177.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.769 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.7 t80 -59.08 -56.48 21.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 118.377 0.535 . . . . 0.0 111.817 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.547 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 28.6 mt-30 -48.84 -35.95 15.79 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.666 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -53.69 -43.88 69.28 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.418 0.554 . . . . 0.0 111.218 179.61 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.869 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.3 mt -65.47 -55.38 18.27 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.676 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -66.8 -25.49 66.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.96 179.778 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.36 -25.28 23.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.919 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.696 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.3 m-30 -88.12 -51.24 5.9 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.696 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.9 OUTLIER 132.53 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 O-C-N 125.069 1.481 . . . . 0.0 110.996 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.445 ' CG1' HD23 ' B' ' 117' ' ' LEU . 7.8 p -142.72 -39.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 61.63 -120.96 0.75 Allowed 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.673 ' HB ' HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.48 6.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.452 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.77 -63.92 0.54 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.13 0.491 . . . . 0.0 110.369 -178.253 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.55 -27.66 26.61 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.167 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.645 HD13 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -61.99 -62.22 1.94 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.44 0.296 . . . . 0.0 110.789 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.714 HG21 HG21 ' A' ' 24' ' ' ILE . 2.1 t -50.29 -59.27 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.783 178.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.688 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.5 p -50.39 -38.0 40.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 99.5 m -72.23 -55.6 6.95 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.523 HG21 ' HG ' ' A' ' 27' ' ' LEU . 54.5 m -56.52 -40.28 74.77 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.261 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.864 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -54.17 -56.12 21.27 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.731 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -58.33 -37.68 75.61 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.07 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -29.01 69.29 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.65 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -65.35 -47.75 75.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.95 0.405 . . . . 0.0 110.273 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.431 ' HA ' ' HD3' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -72.76 -50.98 21.01 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.738 0.78 . . . . 0.0 110.386 178.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.638 0 CA-C-N 114.078 -1.419 . . . . 0.0 113.78 -177.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.665 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 1.5 mmtt . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 121.188 0.518 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 108' ' ' THR . 13.5 tp60 -95.36 121.56 37.15 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.71 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.0 OUTLIER -77.68 102.95 7.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 121.499 0.666 . . . . 0.0 111.573 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.68 HG22 ' CD1' ' B' ' 114' ' ' TYR . 1.1 pt -100.79 111.57 30.88 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.548 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.54 120.48 38.87 Favored 'General case' 0 C--N 1.313 -1.02 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.846 -176.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.596 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.43 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.31 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.9 OUTLIER -68.06 79.94 0.22 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 -178.578 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.72 HG12 ' HB2' ' A' ' 14' ' ' TYR . 18.6 m -75.54 -145.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.701 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.66 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.94 -12.61 0.33 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.0 m -118.72 -62.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.09 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.856 ' HB2' ' CB ' ' B' ' 129' ' ' SER . 1.3 p30 -47.5 -91.84 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -175.87 41.19 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.423 -0.798 . . . . 0.0 111.342 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.78 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.2 OUTLIER -79.16 -41.8 27.63 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.564 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.59 -46.33 39.2 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -176.718 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.869 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -47.92 -33.88 8.26 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.598 0.713 . . . . 0.0 112.304 179.547 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -77.4 -60.48 2.35 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.705 179.577 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.564 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -59.41 -25.65 64.49 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.308 179.51 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -59.12 -31.32 68.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.232 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.785 ' CE2' HD21 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -93.78 -27.95 16.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.565 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 27.5 t70 121.46 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.133 0.973 . . . . 0.0 110.812 176.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.697 HG13 HD21 ' A' ' 17' ' ' LEU . 8.5 p -150.25 77.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.565 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.542 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -73.54 51.98 0.37 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 0.0 111.935 -179.898 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.713 ' HB ' HG22 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 40.75 -2.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 118.479 2.77 . . . . 0.0 118.479 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 23' ' ' ASN . 3.9 p -38.19 -62.96 0.52 Allowed 'General case' 0 C--O 1.24 0.587 0 CA-C-N 119.479 1.036 . . . . 0.0 110.378 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.424 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -85.64 -34.41 13.73 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.988 177.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.593 HD13 HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -53.4 -61.34 2.36 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 120.825 0.345 . . . . 0.0 110.592 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.713 HG22 ' HB ' ' A' ' 24' ' ' ILE . 2.2 t -50.99 -68.24 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.473 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.607 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.4 m -50.09 -41.27 47.89 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 2.0 m -70.03 -51.63 30.6 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.12 -38.73 71.17 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.549 178.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.886 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.0 mtt -60.32 -56.17 24.68 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.82 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -48.85 -40.86 31.17 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.052 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -63.62 -57.06 11.27 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -10.09 59.21 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.093 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.0 -37.65 17.31 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -50.33 19.24 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.996 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.637 0 CA-C-N 113.948 -1.478 . . . . 0.0 111.876 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 8.4 mttm . . . . . 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.567 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -105.97 100.34 9.9 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.459 0.647 . . . . 0.0 110.86 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.671 ' NH2' HG21 ' B' ' 106' ' ' THR . 4.1 ttp180 -78.99 99.45 6.86 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.337 0.589 . . . . 0.0 110.632 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.682 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 21.8 pt -104.31 129.88 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.784 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 177.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.671 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.4 OUTLIER -131.35 125.83 33.68 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.428 -0.909 . . . . 0.0 112.84 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.666 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.8 98.29 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.71 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.1 p -66.87 95.79 0.39 Allowed 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.665 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 2.9 t -85.77 -128.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.915 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.582 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 24.0 t70 82.66 -12.56 0.89 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.923 0.783 . . . . 0.0 108.939 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -125.12 -61.44 1.29 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.01 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.607 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.9 OUTLIER -44.4 -94.4 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.577 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.41 ' N ' ' HB3' ' A' ' 29' ' ' SER . 34.2 t 179.42 41.75 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.871 0.759 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.879 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -83.51 -45.32 13.72 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.668 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.5 mt-30 -48.89 -39.27 25.31 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -174.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.533 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -58.29 -52.62 64.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.239 0.927 . . . . 0.0 111.752 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.886 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -49.07 -49.97 38.97 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.432 0.634 . . . . 0.0 111.422 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.668 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 2.1 pttt -76.01 -29.25 58.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.474 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.474 ' HB2' ' HA ' ' B' ' 116' ' ' LEU . . . -64.12 -28.18 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.083 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.575 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -87.72 -42.75 12.41 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 118.819 -0.61 . . . . 0.0 109.699 178.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 155.89 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 176.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.51 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 76.0 t -154.19 91.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 121.816 -0.552 . . . . 0.0 111.777 -177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.469 ' O ' ' HE3' ' A' ' 32' ' ' MET . 0.0 OUTLIER -57.51 -88.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 178.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.704 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -154.72 -0.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 115.864 1.801 . . . . 0.0 115.864 179.039 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.565 ' HA ' HG21 ' A' ' 7' ' ' VAL . 22.0 p -39.46 -63.16 0.59 Allowed 'General case' 0 C--O 1.241 0.62 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.563 -179.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.82 -30.11 24.5 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 121.293 -0.48 . . . . 0.0 112.214 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.521 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 5.8 tp -58.59 -61.03 2.9 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.776 0.288 . . . . 0.0 110.33 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.704 HG21 ' HB ' ' B' ' 124' ' ' ILE . 2.5 t -51.37 -64.63 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.012 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.856 ' CB ' ' HB2' ' A' ' 12' ' ' ASP . 7.8 p -48.41 -45.0 35.53 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -46.63 51.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 25.4 m -60.64 -37.9 83.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.917 178.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.84 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.79 -58.4 8.74 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.978 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -58.79 -36.06 73.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.888 -178.875 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -74.07 -49.51 23.73 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.529 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.728 ' HG3' HD22 ' A' ' 17' ' ' LEU . 21.6 tp10 -69.95 -20.24 63.34 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.869 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.36 -52.78 5.01 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 13.8 mtt180 -57.28 -56.62 19.5 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 121.503 0.668 . . . . 0.0 110.2 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.426 ' HD3' ' O ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.021 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.623 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm . . . . . 0 N--CA 1.467 0.4 0 CA-C-O 120.866 0.365 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.66 ' HB3' HG23 ' B' ' 109' ' ' VAL . 1.7 tt0 -109.83 108.82 19.27 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.028 0.442 . . . . 0.0 110.235 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.816 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.1 ttm105 -79.63 110.15 14.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.969 . . . . 0.0 112.239 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.722 HG23 ' CD2' ' B' ' 114' ' ' TYR . 0.4 OUTLIER -104.82 130.95 55.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 176.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.704 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -131.48 130.02 41.9 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.435 -1.306 . . . . 0.0 113.523 -177.213 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.51 98.21 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.619 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.503 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 1.2 p -71.08 67.42 0.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.581 0.705 . . . . 0.0 109.529 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.658 HG11 ' CB ' ' A' ' 14' ' ' TYR . 7.1 p -88.83 -131.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-O 117.433 -1.27 . . . . 0.0 109.961 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.691 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 32.3 t70 114.43 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 119.759 1.163 . . . . 0.0 110.975 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 63.1 p 173.64 -27.29 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.524 -1.217 . . . . 0.0 113.379 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.718 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 33.0 m-20 -80.89 70.06 7.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.249 -0.981 . . . . 0.0 112.118 -177.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.548 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 34.5 m 57.46 -11.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 178.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.806 ' CE1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -56.84 -53.77 54.07 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.113 0.87 . . . . 0.0 109.868 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.7 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.2 mt-30 -49.35 -42.24 41.25 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.476 -178.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -56.06 20.5 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.371 0.532 . . . . 0.0 111.843 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.777 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.06 -47.55 33.82 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.121 -179.18 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.725 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 22.8 pttt -79.42 -30.5 42.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.178 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -26.39 68.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.862 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.522 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.02 -43.94 11.35 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 118.636 -0.697 . . . . 0.0 109.481 178.418 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.522 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 154.49 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 176.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.447 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 74.4 t -157.93 90.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 CA-C-O 120.785 0.326 . . . . 0.0 110.642 -178.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.725 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -57.22 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.404 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.7 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -150.08 -2.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 179.866 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 24' ' ' ILE . 55.6 p -39.61 -65.01 0.42 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.896 -177.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.66 -24.33 50.33 Favored Glycine 0 C--O 1.228 -0.25 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.603 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.569 HD11 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.24 -62.27 1.72 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 122.482 0.313 . . . . 0.0 111.324 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.7 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.5 t -53.18 -62.74 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 O-C-N 123.02 0.2 . . . . 0.0 110.815 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.768 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 12.9 p -48.35 -40.04 24.15 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.553 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -75.7 -45.82 34.68 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.416 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.505 ' OG1' ' HA ' ' A' ' 28' ' ' VAL . 1.9 p -57.84 -45.01 86.86 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 178.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.856 ' SD ' HD12 ' B' ' 117' ' ' LEU . 4.0 mmt -57.5 -57.19 13.77 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.151 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.414 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -57.91 -39.83 78.89 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -63.65 -57.27 10.59 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.843 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.97 -14.49 62.38 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.825 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.798 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.22 -28.85 22.13 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 120.998 0.428 . . . . 0.0 110.822 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -49.84 10.9 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.974 0.893 . . . . 0.0 109.277 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.78 0 CA-C-N 113.884 -1.507 . . . . 0.0 112.554 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.202 0.525 . . . . 0.0 111.613 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.691 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.8 OUTLIER -111.04 108.29 17.97 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.526 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.574 ' CZ ' HG23 ' B' ' 106' ' ' THR . 5.0 ttp180 -77.44 104.67 8.1 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.474 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.806 HG13 ' CE1' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -95.61 109.17 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.668 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.705 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -117.95 116.94 27.94 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 118.759 -1.176 . . . . 0.0 113.158 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.634 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -100.73 103.18 14.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.816 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 17.9 p -70.33 87.3 0.61 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.777 0.799 . . . . 0.0 110.249 -178.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.794 HG21 ' CD1' ' B' ' 114' ' ' TYR . 19.7 m -72.78 -137.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.912 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.527 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.9 t0 92.3 -8.43 0.2 Allowed 'General case' 0 C--N 1.356 0.864 0 CA-C-O 121.458 0.646 . . . . 0.0 109.603 -177.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 6.1 t -136.47 -55.24 0.74 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.489 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.768 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -44.04 -94.25 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -177.625 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 32' ' ' MET . 0.1 OUTLIER 176.48 37.56 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.963 0.802 . . . . 0.0 110.939 -179.508 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.794 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.22 -43.97 15.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -179.293 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.713 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.2 mm100 -47.55 -37.46 12.3 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -174.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.798 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -64.32 -56.96 10.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.053 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.856 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -52.33 -41.42 62.98 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.255 -177.142 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.713 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.3 OUTLIER -79.38 -29.37 42.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.627 -179.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.535 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -64.38 -30.63 71.67 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.39 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.632 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.95 -40.47 13.02 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.499 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.632 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 22.2 t70 170.2 15.01 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.682 ' CG1' ' HB2' ' B' ' 127' ' ' LEU . 51.4 t -135.45 76.15 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 121.333 -0.854 . . . . 0.0 113.101 -177.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.655 ' HA ' ' CB ' ' B' ' 118' ' ' LYS . 1.8 m120 -66.06 57.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.657 HG22 ' CE ' ' A' ' 32' ' ' MET . 0.2 OUTLIER 50.99 -26.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.738 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.96 -64.22 0.42 Allowed 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.395 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.57 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.37 -20.77 53.92 Favored Glycine 0 C--O 1.227 -0.332 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.415 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.682 ' HB2' ' CG1' ' B' ' 122' ' ' VAL . 0.3 OUTLIER -59.39 -60.35 4.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.684 ' O ' ' HG2' ' B' ' 132' ' ' MET . 74.8 t -54.1 -65.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.719 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.718 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 52.5 p -49.17 -46.95 46.14 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.57 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -75.41 -50.33 16.21 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 119.376 0.989 . . . . 0.0 110.358 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.12 -44.14 74.73 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.435 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.777 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 5.7 mmt -52.35 -45.66 65.78 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.203 178.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.548 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -52.93 -48.0 67.63 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.904 0.383 . . . . 0.0 111.535 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.7 -51.59 67.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -77.4 -9.29 58.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.977 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -88.05 -33.97 18.13 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -55.67 5.45 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 121.782 0.801 . . . . 0.0 109.354 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.526 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 4.6 mmp_? . . . . . 0 N--CA 1.442 -0.866 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.457 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.334 0 CA-C-O 120.658 0.266 . . . . 0.0 110.945 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.749 ' HB3' ' CB ' ' B' ' 110' ' ' ASP . 1.4 tp60 -114.55 129.11 56.64 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.762 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.758 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 15.1 ttp85 -78.31 99.41 6.31 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.714 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.784 HG23 ' CG ' ' B' ' 114' ' ' TYR . 1.3 pt -94.61 113.86 30.01 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.236 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.713 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.754 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.6 OUTLIER -119.6 122.69 42.14 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.092 -1.043 . . . . 0.0 112.581 -178.013 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.633 ' CG1' ' CG2' ' B' ' 105' ' ' ILE . 2.1 p -99.23 106.75 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 114.242 -1.345 . . . . 0.0 107.936 177.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.419 HG22 ' HG3' ' B' ' 104' ' ' ARG . 0.7 OUTLIER -70.1 68.09 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.098 0.951 . . . . 0.0 108.6 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.729 ' CG2' ' HB3' ' A' ' 14' ' ' TYR . 9.8 p -72.54 -142.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.581 -1.645 . . . . 0.0 112.895 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.662 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 7.1 t70 86.61 -5.3 0.72 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.763 0.792 . . . . 0.0 109.311 -176.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.46 -73.03 0.66 Allowed 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.341 177.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.728 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.0 m-20 -32.94 -77.26 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.789 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.484 ' N ' ' HB2' ' B' ' 129' ' ' SER . 1.8 m 167.22 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.188 0.518 . . . . 0.0 111.106 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.89 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -84.6 -47.14 10.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 179.728 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.563 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.9 mt-30 -48.91 -38.94 24.23 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -174.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.07 -57.61 9.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.485 1.038 . . . . 0.0 111.574 179.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.701 ' HG ' ' HA ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -55.4 -44.25 76.01 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.648 -177.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.6 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -76.28 -25.65 55.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.065 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -29.27 53.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.732 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.653 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.4 m-30 -87.71 -46.24 9.67 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 177.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 138.51 34.94 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.874 1.359 . . . . 0.0 111.223 177.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.511 ' O ' HD13 ' A' ' 17' ' ' LEU . 16.4 t -116.01 76.59 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.014 0.435 . . . . 0.0 111.875 -178.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' ' CD1' ' A' ' 24' ' ' ILE . 16.2 p30 -67.84 44.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.763 HG12 ' HE1' ' B' ' 132' ' ' MET . 0.7 OUTLIER 39.52 1.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 178.044 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' ASN . 6.9 p -38.57 -63.59 0.5 Allowed 'General case' 0 C--O 1.244 0.802 0 CA-C-N 119.048 0.84 . . . . 0.0 110.904 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.422 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -86.22 -21.37 52.36 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.613 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.616 HD11 HD11 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -71.2 -62.54 1.36 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.896 0.348 . . . . 0.0 111.223 -179.376 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.646 HG23 HG21 ' B' ' 128' ' ' VAL . 2.1 t -51.05 -62.23 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.648 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 17.8 p -48.83 -31.12 6.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 122.651 0.38 . . . . 0.0 111.842 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -77.06 -57.92 3.57 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.401 HG21 HD21 ' B' ' 127' ' ' LEU . 9.0 m -52.96 -44.64 67.26 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.158 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.779 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 3.4 mmt -49.34 -43.55 43.86 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.411 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.55 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -63.61 -48.77 75.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.106 0.412 . . . . 0.0 110.44 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.49 ' O ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -60.82 -53.34 58.51 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -61.6 -41.8 97.95 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.269 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.768 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -58.46 -44.44 89.26 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.352 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.401 ' NH2' ' OE1' ' A' ' 33' ' ' GLN . 4.6 mtt-85 -69.5 -54.53 13.76 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 34' ' ' ASN . 3.8 mmp_? . . . . . 0 N--CA 1.445 -0.721 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.232 -178.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 15.4 mmtt . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.662 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 11.5 tp60 -125.97 124.64 41.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.083 0.468 . . . . 0.0 111.231 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.444 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.31 112.24 16.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.032 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.89 HG13 ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -107.16 128.94 61.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.182 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.175 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.743 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -131.47 120.18 22.63 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.696 -179.804 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.603 HG11 HD12 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -103.5 93.69 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 174.342 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.758 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 41.8 p -70.52 89.31 0.7 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.045 -1.034 . . . . 0.0 109.687 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.651 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 21.6 m -141.35 -0.98 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.749 ' CB ' ' HB3' ' A' ' 3' ' ' GLN . 0.0 OUTLIER 17.85 -74.65 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.645 1.111 . . . . 0.0 112.209 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.62 ' N ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -66.7 -20.16 65.91 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -179.143 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.651 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 1.2 t0 -78.72 62.8 3.33 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 120.017 1.28 . . . . 0.0 111.132 -178.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.55 ' HB3' ' CA ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER 58.91 -24.87 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 179.507 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.784 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.02 -56.52 3.29 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-O 121.708 0.766 . . . . 0.0 110.424 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' B' ' 110' ' ' ASP . 20.3 pt20 -49.54 -39.93 36.37 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.713 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.768 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -60.61 -43.84 97.0 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.664 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.779 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.45 -50.03 74.43 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.457 0.646 . . . . 0.0 111.439 -179.314 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.673 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.8 pttt -70.13 -25.88 63.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.581 178.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.443 ' HB2' ' O ' ' B' ' 116' ' ' LEU . . . -60.38 -26.67 66.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.54 177.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.682 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.7 OUTLIER -88.41 -44.94 10.38 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.372 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 150.13 63.0 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 176.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.661 ' CG1' HD21 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -157.6 -42.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.673 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER 58.18 59.26 3.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.465 0.65 . . . . 0.0 110.014 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.763 ' CG1' ' HE2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 40.53 -11.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 118.478 2.77 . . . . 0.0 118.478 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.559 ' HA ' ' CG2' ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.03 -56.43 1.15 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.112 -177.888 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.76 -24.63 52.66 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.533 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.665 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 1.0 OUTLIER -70.32 -61.48 1.76 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.971 0.509 . . . . 0.0 111.142 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.646 HG21 HG23 ' A' ' 28' ' ' VAL . 71.0 t -46.42 -54.4 2.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.728 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.05 -40.73 86.01 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 90.6 m -74.05 -49.84 22.36 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.513 HG22 ' HA ' ' B' ' 128' ' ' VAL . 3.4 t -55.34 -30.86 61.08 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.674 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.763 ' HE1' HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.69 -57.61 11.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.779 179.023 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -46.03 85.07 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -64.54 -50.59 66.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.812 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.596 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -71.84 -25.04 61.81 Favored 'General case' 0 C--O 1.217 -0.642 0 C-N-CA 120.349 -0.54 . . . . 0.0 110.069 178.267 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -71.56 -46.33 59.72 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 177.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -60.17 -56.02 26.66 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.505 0.669 . . . . 0.0 110.126 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? . . . . . 0 N--CA 1.445 -0.679 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.866 -177.559 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 120.351 0.119 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.85 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -122.77 110.02 14.94 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.651 0.739 . . . . 0.0 111.528 -179.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.795 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.2 ttm105 -83.64 113.96 21.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.246 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.667 HD13 ' CG1' ' B' ' 107' ' ' VAL . 0.1 OUTLIER -104.51 130.6 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.763 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -126.79 126.01 42.68 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.806 -0.758 . . . . 0.0 112.735 -177.469 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.627 ' CG1' ' CG2' ' B' ' 105' ' ' ILE . 0.6 OUTLIER -100.51 109.09 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.627 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -70.67 68.31 0.39 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.683 0.754 . . . . 0.0 109.333 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.726 HG22 ' HB3' ' A' ' 14' ' ' TYR . 8.3 p -76.23 -143.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.253 -1.34 . . . . 0.0 111.795 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.707 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 7.2 t70 87.43 1.56 0.44 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-O 122.067 0.937 . . . . 0.0 109.86 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.5 m -129.24 -64.72 0.89 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.18 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.763 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 1.2 m-20 -42.37 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.998 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m 178.54 41.61 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.607 0.639 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.894 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.5 OUTLIER -82.83 -49.48 9.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -179.166 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.66 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.1 mm-40 -48.15 -36.55 13.69 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -173.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HB3' ' HB3' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.8 -53.29 59.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.86 0.754 . . . . 0.0 112.183 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.871 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.97 -45.76 51.78 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.236 0.541 . . . . 0.0 111.553 -178.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -77.73 -25.73 49.48 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.852 178.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -28.65 69.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.621 178.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.67 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -88.12 -41.93 12.7 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.587 178.386 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 154.23 14.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 176.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.67 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 70.3 t -152.66 92.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 121.794 -0.566 . . . . 0.0 112.086 -177.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.533 ' HB2' HD11 ' A' ' 24' ' ' ILE . 4.8 p30 -58.41 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.762 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.29 -2.67 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 115.599 1.704 . . . . 0.0 115.599 178.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -39.29 -64.37 0.47 Allowed 'General case' 0 C--O 1.245 0.82 0 C-N-CA 119.922 -0.711 . . . . 0.0 109.346 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.62 -28.67 26.2 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.058 -0.591 . . . . 0.0 111.964 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.597 ' CB ' ' HA ' ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.71 -61.12 2.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.597 0.359 . . . . 0.0 110.752 179.238 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.762 HG23 ' HB ' ' A' ' 24' ' ' ILE . 2.4 t -51.98 -63.72 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.693 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 5.4 p -49.15 -39.05 27.41 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.5 m -71.88 -58.42 3.48 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.46 HG23 ' OG1' ' B' ' 131' ' ' THR . 19.2 m -53.92 -42.84 69.22 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.01 179.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.794 ' SD ' HD13 ' B' ' 117' ' ' LEU . 11.4 mmt -56.61 -57.3 12.98 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.855 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -38.84 65.34 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -53.5 24.97 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.349 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.603 ' HB3' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -67.84 -25.94 65.8 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.248 178.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.534 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.93 -43.7 64.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -50.62 72.83 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.939 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.449 -0.522 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.221 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt . . . . . 0 N--CA 1.467 0.409 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.707 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.2 tt0 -113.97 126.25 54.93 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.355 0.598 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.481 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.86 108.32 11.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.433 -178.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.894 HG13 ' CD1' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -101.59 109.22 25.32 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.962 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.192 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.681 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -116.91 114.97 24.6 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.468 -178.488 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.667 ' CG1' HD13 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.31 111.94 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.795 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -70.02 91.47 0.68 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -179.704 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.613 HG23 ' CB ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -96.28 -158.88 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 112.152 -178.228 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.85 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 13.3 t70 96.71 -5.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.23 -61.55 1.66 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 175.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.693 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -49.93 -90.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.692 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 33.3 t -179.68 40.25 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.168 0.895 . . . . 0.0 111.229 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.657 ' CZ ' ' CG2' ' A' ' 5' ' ' ILE . 1.1 t80 -82.71 -50.13 9.04 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.527 ' CD ' ' HA ' ' B' ' 110' ' ' ASP . 0.3 OUTLIER -47.39 -38.41 13.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.581 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.504 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.05 -44.0 64.06 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.612 1.096 . . . . 0.0 112.349 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.794 HD13 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -68.07 -47.76 67.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.075 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.585 ' HG2' ' CE1' ' B' ' 114' ' ' TYR . 2.8 pttt -72.06 -29.88 64.58 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.552 0.692 . . . . 0.0 110.483 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.98 -28.75 67.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.463 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.563 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.4 OUTLIER -88.46 -42.58 12.04 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.591 -0.719 . . . . 0.0 110.476 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.563 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.6 28.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 177.067 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.44 ' CG2' ' O ' ' B' ' 121' ' ' ASP . 68.7 t -160.65 96.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 122.209 -0.307 . . . . 0.0 111.726 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.573 ' O ' ' HE3' ' A' ' 32' ' ' MET . 2.5 m-20 -60.03 -102.75 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 178.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.67 ' HB ' HG22 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -145.12 6.83 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 179.037 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 124' ' ' ILE . 2.6 p -41.6 -64.25 0.6 Allowed 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.629 0.728 . . . . 0.0 109.687 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.91 -23.19 42.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.658 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.683 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -62.47 -57.27 11.83 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.719 0.259 . . . . 0.0 111.018 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.67 HG22 ' HB ' ' B' ' 124' ' ' ILE . 5.4 t -54.21 -62.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.763 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 14.8 p -50.42 -44.19 55.09 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 87.5 m -68.55 -57.34 5.92 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.46 ' OG1' HG23 ' A' ' 31' ' ' THR . 0.7 OUTLIER -54.0 -44.41 70.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.397 179.594 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.871 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 5.3 mtt -60.21 -58.02 10.31 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.438 178.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.0 OUTLIER -49.35 -44.56 44.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.4 -179.679 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -64.1 -57.4 9.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.565 0.222 . . . . 0.0 110.778 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.435 ' HB2' HD23 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.4 -15.18 62.81 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -88.69 -29.1 20.13 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 123.234 0.613 . . . . 0.0 111.089 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.58 -48.68 10.7 Favored 'General case' 0 CA--C 1.504 -0.825 0 CA-C-O 121.909 0.861 . . . . 0.0 110.118 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 . . . . . 0 C--N 1.319 -0.724 0 CA-C-N 113.771 -1.559 . . . . 0.0 114.298 -176.983 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 121.065 0.46 . . . . 0.0 111.037 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.724 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -103.81 111.87 24.57 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.344 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.733 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.89 105.89 9.38 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.121 -178.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.644 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -103.94 120.98 54.91 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.993 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 175.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.672 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -124.76 124.15 41.52 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.894 -177.199 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.74 108.08 21.99 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.51 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 27.3 p -70.64 89.96 0.74 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.753 0.311 . . . . 0.0 110.997 -178.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.73 HG22 ' CG ' ' A' ' 14' ' ' TYR . 3.0 t -84.44 -133.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.928 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.521 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.7 t0 85.73 -9.93 0.75 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.166 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t -135.21 -54.19 0.8 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.388 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.713 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.4 m-20 -47.39 -103.28 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -178.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.61 35.32 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.767 0.794 . . . . 0.0 111.05 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.73 ' CG ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.0 -38.68 22.3 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.595 1.158 . . . . 0.0 112.608 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.628 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.63 -43.99 36.88 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -176.259 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.658 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -54.35 -44.07 71.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.316 0.962 . . . . 0.0 112.26 -179.41 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.845 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -59.15 -52.38 65.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.622 0.725 . . . . 0.0 111.239 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -74.01 -29.37 61.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.752 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.4 -27.93 69.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.267 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.3 OUTLIER -88.41 -45.02 10.32 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 118.585 -0.722 . . . . 0.0 110.356 179.096 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 159.85 18.89 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.029 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.438 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 65.3 t -157.87 98.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 CA-C-N 118.411 0.551 . . . . 0.0 112.017 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 31.1 m-80 -57.31 -96.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.722 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.71 5.87 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 178.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.63 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.2 t -39.34 -64.58 0.45 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.399 -177.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.86 -25.87 28.38 Favored Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.433 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.693 ' CD1' ' HG ' ' A' ' 17' ' ' LEU . 6.6 tt -58.61 -61.65 2.44 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.992 0.425 . . . . 0.0 109.885 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.722 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.3 t -49.96 -62.8 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.965 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.861 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.877 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 95.4 p -49.45 -43.42 44.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.05 -47.91 40.65 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.254 -0.646 . . . . 0.0 109.254 179.68 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.462 ' CG2' HG22 ' B' ' 131' ' ' THR . 23.3 m -61.47 -34.59 75.72 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.883 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.6 OUTLIER -63.97 -56.86 12.04 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.79 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.502 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -50.23 -34.13 21.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.69 0.281 . . . . 0.0 110.752 179.504 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.4 m-20 -75.36 -50.29 16.4 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.168 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.62 ' HB3' HD22 ' B' ' 117' ' ' LEU . 1.7 mm-40 -67.76 -23.47 65.23 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.06 178.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.65 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.0 -50.12 24.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -56.1 10.42 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.295 178.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.518 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.394 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.155 0.502 . . . . 0.0 110.911 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.521 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 27.2 tt0 -98.79 114.23 26.69 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.887 179.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.499 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.76 102.33 7.12 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.453 -178.164 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.672 ' O ' ' HA ' ' A' ' 6' ' ' THR . 1.1 pt -100.79 109.74 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.71 117.18 29.55 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -175.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.63 HG22 ' HA ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -101.16 104.47 16.31 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 173.794 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.733 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 44.6 p -70.1 85.12 0.54 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.209 0.528 . . . . 0.0 110.774 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.64 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 1.6 t -82.3 -138.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.064 -178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.724 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 4.3 t70 86.03 -5.34 0.8 Allowed 'General case' 0 C--N 1.35 0.624 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -175.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.54 -63.13 1.1 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.508 -1.223 . . . . 0.0 107.919 177.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.877 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -47.25 -92.44 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -179.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 26.6 t -178.82 40.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 118.903 0.774 . . . . 0.0 111.435 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.815 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.9 -41.5 18.83 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.759 0.824 . . . . 0.0 112.529 179.709 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.652 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.75 -39.55 25.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -174.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.65 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.49 -50.72 72.83 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.413 1.006 . . . . 0.0 111.944 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.883 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.1 mt -53.8 -43.57 69.45 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.599 0.714 . . . . 0.0 111.767 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.652 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 7.8 pttt -79.19 -32.53 44.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.52 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -61.93 -26.5 68.22 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.573 -1.194 . . . . 0.0 110.166 178.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.636 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.09 -39.52 14.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.881 179.291 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.636 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 26.2 t0 138.14 49.95 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.562 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 0.3 OUTLIER -159.96 -37.06 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.891 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' B' ' 122' ' ' VAL . 11.9 p30 55.61 -109.61 0.5 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.707 HG23 HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.2 1.38 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.655 ' HA ' ' CG2' ' A' ' 7' ' ' VAL . 13.3 t -38.82 -64.28 0.45 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.871 -178.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -89.35 -26.88 24.4 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.769 177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.568 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -55.66 -61.84 2.09 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.227 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.627 ' O ' ' HG2' ' B' ' 132' ' ' MET . 2.7 t -54.37 -55.49 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.312 0.577 . . . . 0.0 110.044 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.713 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 29.1 t -47.14 -47.66 23.49 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.1 -47.07 12.04 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.657 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.462 HG22 ' CG2' ' A' ' 31' ' ' THR . 2.4 m -56.43 -48.27 77.33 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.695 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.845 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 5.5 mmt -51.62 -48.55 63.25 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.768 179.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -54.58 -36.38 64.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -48.31 46.06 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.543 ' HB3' HD22 ' A' ' 17' ' ' LEU . 5.4 tt0 -74.62 -21.7 59.32 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.943 0.402 . . . . 0.0 110.376 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.658 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.09 -32.98 50.91 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.282 0.633 . . . . 0.0 110.754 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.2 mtt85 -81.98 -51.97 7.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.592 0.71 . . . . 0.0 110.655 179.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -176.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.651 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.551 ' O ' ' HA ' ' B' ' 108' ' ' THR . 59.9 tp60 -100.14 120.33 39.71 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.016 0.436 . . . . 0.0 110.869 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.645 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.3 ttm-85 -79.29 112.44 16.52 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -177.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.673 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -118.2 122.18 68.99 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 176.77 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.733 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -131.54 140.36 49.47 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 118.918 -1.113 . . . . 0.0 112.909 -178.168 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.715 HG21 ' HB ' ' A' ' 9' ' ' VAL . 2.0 m -100.83 107.99 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.7 OUTLIER -70.42 67.64 0.34 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.622 0.725 . . . . 0.0 109.596 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.715 ' HB ' HG21 ' A' ' 7' ' ' VAL . 7.9 p -95.88 -137.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.03 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 1.0 OUTLIER 166.15 -82.83 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -178.903 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.593 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -104.8 9.89 34.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.19 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.733 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -80.22 68.33 6.33 Favored 'General case' 0 C--N 1.359 0.98 0 CA-C-N 119.807 1.185 . . . . 0.0 108.706 179.416 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.479 ' HB3' ' N ' ' B' ' 133' ' ' GLN . 2.6 m 61.16 -28.59 0.05 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.682 -1.144 . . . . 0.0 113.736 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.668 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.2 OUTLIER -45.91 -60.26 2.35 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.149 0.5 . . . . 0.0 111.115 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.6 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.3 pt20 -48.75 -38.26 21.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.938 -177.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.595 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.02 -46.56 87.88 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.694 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -55.34 -49.69 71.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.474 0.654 . . . . 0.0 110.849 -179.724 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.659 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.3 pttt -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.538 179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -59.23 -29.39 67.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.337 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.591 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.3 -44.33 10.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.526 178.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.591 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 152.28 27.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.393 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.498 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 76.4 t -160.15 87.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.634 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -53.89 -87.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.576 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.746 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -155.22 -1.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 179.515 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.541 ' HA ' HG23 ' B' ' 107' ' ' VAL . 67.3 p -38.91 -64.51 0.44 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-N 118.941 0.791 . . . . 0.0 111.681 -176.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.58 -19.99 57.26 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.774 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.544 ' CD1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -66.8 -61.66 1.84 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 122.766 0.426 . . . . 0.0 110.741 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.696 HG22 ' HB ' ' A' ' 24' ' ' ILE . 10.0 t -50.55 -60.4 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 C-N-CA 120.309 -0.556 . . . . 0.0 109.923 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.848 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 8.8 p -50.1 -41.78 48.98 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.8 m -67.1 -52.47 41.51 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.1 m -61.24 -34.6 75.4 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.836 178.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.912 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -65.88 -58.15 6.25 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.562 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.458 ' OE1' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.92 -33.99 19.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.718 0.294 . . . . 0.0 110.885 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.41 -50.73 12.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.831 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.522 ' HB3' HD23 ' B' ' 117' ' ' LEU . 1.4 mm-40 -70.83 -19.14 62.69 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.318 177.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.605 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -84.49 -49.11 8.93 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.664 0.786 . . . . 0.0 110.88 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.458 ' HD2' ' OE1' ' A' ' 33' ' ' GLN . 4.7 mtt85 -57.49 -53.7 55.18 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.389 0.614 . . . . 0.0 110.886 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? . . . . . 0 N--CA 1.448 -0.565 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.869 -178.772 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.473 0 CA-C-O 120.592 0.235 . . . . 0.0 111.052 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.514 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 3.3 tt0 -109.93 110.57 21.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.132 0.492 . . . . 0.0 112.129 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.448 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 7.8 ttm105 -78.69 102.38 8.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.649 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -99.09 116.09 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 178.891 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.733 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -115.74 124.5 50.96 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.599 -176.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.641 HG21 ' HB ' ' A' ' 24' ' ' ILE . 1.1 t -100.6 98.7 7.23 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.645 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 48.4 p -70.16 98.66 1.37 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.97 -0.456 . . . . 0.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.758 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -88.98 -129.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.421 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 22.5 t70 85.47 -9.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 67.3 p -131.5 -61.33 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.824 178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.848 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.27 -92.54 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 28.5 t 170.85 39.38 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.731 0.776 . . . . 0.0 110.149 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.912 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -84.23 -45.17 13.16 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.26 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.479 ' HA ' ' CE ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.7 -34.92 12.87 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.305 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -60.71 -56.92 15.51 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.678 0.672 . . . . 0.0 111.549 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.903 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.9 mt -47.16 -48.85 23.36 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.069 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.658 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -77.04 -26.21 53.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.643 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.82 -30.4 71.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.699 178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.563 ' CD1' ' N ' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.16 -41.41 13.02 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.789 178.408 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.563 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 152.95 26.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.029 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.578 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.6 OUTLIER -135.29 80.1 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -179.001 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.579 ' O ' HD13 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.69 53.74 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.652 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.733 HG22 ' HE3' ' A' ' 32' ' ' MET . 0.4 OUTLIER 42.35 -9.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 118.701 2.852 . . . . 0.0 118.701 178.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.553 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.25 -63.15 0.51 Allowed 'General case' 0 C--O 1.244 0.773 0 CA-C-N 119.601 1.091 . . . . 0.0 110.946 -176.966 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.49 -26.78 34.72 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.693 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.59 ' CD1' ' CD1' ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.4 -61.51 2.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.628 0.371 . . . . 0.0 110.436 179.332 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.649 HG23 ' HB ' ' B' ' 124' ' ' ILE . 4.0 t -47.74 -64.31 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.733 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.05 -34.8 10.06 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 178.574 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 98.8 m -72.44 -52.8 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -42.55 99.14 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.424 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.746 ' HE3' ' CG2' ' A' ' 24' ' ' ILE . 6.7 mmt -52.31 -51.17 60.13 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.674 179.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.479 ' N ' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.92 -36.91 68.25 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.702 0.287 . . . . 0.0 111.079 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.4 -52.51 26.25 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.508 ' HB2' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.77 -19.21 62.73 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.61 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.595 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.45 -28.82 21.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 122.776 0.43 . . . . 0.0 111.243 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -54.07 6.39 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 121.652 0.739 . . . . 0.0 109.871 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? . . . . . 0 N--CA 1.441 -0.892 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.12 -178.419 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.563 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.93 0.395 . . . . 0.0 110.981 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.718 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 36.7 tp60 -109.66 117.51 34.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.232 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.765 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.5 ttm180 -78.51 106.12 10.25 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 121.67 0.748 . . . . 0.0 112.221 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.647 ' CD1' ' CD1' ' B' ' 114' ' ' TYR . 7.0 pt -110.41 128.1 66.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 177.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.711 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.03 131.6 42.62 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 118.461 -1.295 . . . . 0.0 113.822 -177.497 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.552 HG12 ' CD1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.48 105.39 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.596 HG21 ' HG3' ' B' ' 104' ' ' ARG . 7.4 p -70.55 91.68 0.8 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.281 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.651 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -88.58 -147.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.805 -178.908 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.589 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 28.4 t70 120.49 -0.28 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.327 1.051 . . . . 0.0 108.511 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.9 p -158.03 -33.12 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.079 -0.964 . . . . 0.0 112.694 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.72 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -75.05 19.9 0.14 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -176.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.56 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 32.5 m 81.38 8.23 1.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 175.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.905 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -63.25 -45.77 90.01 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 7.4 mt-30 -49.62 -41.24 41.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -176.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.578 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -59.53 -48.46 81.56 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.724 HD22 ' HB3' ' B' ' 135' ' ' GLU . 0.4 OUTLIER -50.34 -56.91 9.3 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.525 0.679 . . . . 0.0 111.498 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.635 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 pttt -70.4 -25.83 63.41 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.113 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . . . -65.71 -27.03 68.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.325 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.11 -38.69 15.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 118.316 -0.85 . . . . 0.0 110.264 178.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.3 m-20 148.98 33.84 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 21' ' ' ASP . 41.0 t -151.08 88.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 121.821 -0.55 . . . . 0.0 112.429 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.564 ' O ' HD12 ' A' ' 24' ' ' ILE . 63.4 m-80 -70.04 60.82 0.18 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.3 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.796 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 40.65 -11.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 118.539 2.792 . . . . 0.0 118.539 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.501 ' N ' ' O ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -38.1 -62.05 0.6 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.773 1.17 . . . . 0.0 110.787 -177.619 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.02 -30.97 40.59 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.231 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.509 HD12 ' CD1' ' A' ' 17' ' ' LEU . 2.8 tp -60.27 -61.68 2.42 Favored 'General case' 0 C--N 1.338 0.074 0 O-C-N 122.916 -0.167 . . . . 0.0 111.001 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.796 HG21 ' HB ' ' A' ' 24' ' ' ILE . 37.2 t -45.66 -66.31 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.063 0.459 . . . . 0.0 110.986 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.711 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 15.3 p -49.39 -44.08 44.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.418 ' O ' ' HG2' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -72.72 -44.85 61.19 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.177 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 m -54.42 -38.16 65.93 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.559 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.785 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 5.5 mmt -56.34 -57.38 12.52 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.58 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 30' ' ' THR . 4.5 pt20 -50.44 -38.63 44.45 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.74 0.305 . . . . 0.0 111.317 -179.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -69.88 -51.67 31.23 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.431 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.56 ' HB3' HD22 ' B' ' 117' ' ' LEU . 4.5 tp10 -68.72 -23.11 64.32 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.273 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -79.31 -46.02 18.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.572 0.349 . . . . 0.0 110.689 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.27 -50.8 68.71 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.913 0.863 . . . . 0.0 109.971 178.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.973 0 CA-C-N 113.392 -1.731 . . . . 0.0 113.486 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.421 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 7.6 tt0 -100.34 113.28 25.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.591 178.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.596 ' HG3' HG21 ' A' ' 8' ' ' THR . 4.5 ttm180 -78.38 101.11 7.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.218 0.532 . . . . 0.0 110.607 -179.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.704 HG22 ' CD1' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -99.36 118.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.41 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.711 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -123.22 123.21 40.26 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.152 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.591 HG21 ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.45 103.33 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 175.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.765 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 64.9 p -70.06 67.9 0.3 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.652 0.739 . . . . 0.0 109.751 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.683 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 8.0 p -70.31 -130.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 114.13 -1.396 . . . . 0.0 111.831 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.718 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 25.9 t70 84.89 -5.38 0.95 Allowed 'General case' 0 N--CA 1.485 1.292 0 CA-C-N 119.893 1.224 . . . . 0.0 109.603 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.29 -64.54 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.642 177.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.711 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.81 -84.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.265 -179.816 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.96 44.29 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.132 0.491 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.785 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.3 OUTLIER -83.35 -44.83 14.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.6 mp0 -48.85 -38.95 23.85 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.505 HD21 ' OH ' ' B' ' 120' ' ' TYR . 0.5 OUTLIER -50.17 -56.72 9.84 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.727 0.694 . . . . 0.0 111.761 179.516 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.587 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -58.33 -48.51 80.31 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.034 -179.005 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -73.41 -26.33 60.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.287 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.91 -25.25 42.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.874 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.616 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.4 m-30 -87.97 -51.72 5.66 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.616 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.6 m-20 144.45 48.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 O-C-N 124.36 1.038 . . . . 0.0 112.096 177.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.542 ' CG1' HD12 ' B' ' 117' ' ' LEU . 5.3 p -150.69 85.76 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.538 ' O ' HD12 ' B' ' 124' ' ' ILE . 43.1 m-80 -68.3 59.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.734 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.74 HG12 ' HE1' ' A' ' 32' ' ' MET . 0.8 OUTLIER 37.42 1.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 178.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.09 -62.35 0.57 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.584 1.083 . . . . 0.0 110.373 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -83.33 -31.87 26.87 Favored Glycine 0 C--O 1.223 -0.574 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.169 178.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.703 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.66 -62.02 2.02 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.795 0.438 . . . . 0.0 111.888 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.776 HG22 HG22 ' A' ' 28' ' ' VAL . 1.8 t -52.34 -64.7 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.145 0.497 . . . . 0.0 110.929 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.72 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 84.6 p -50.46 -41.63 53.21 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.816 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.425 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 7.6 m -65.7 -51.88 55.8 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.1 -38.52 62.65 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.879 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.905 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.2 mtt -58.11 -55.52 33.83 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.974 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.549 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -50.57 -39.98 51.04 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.21 0.459 . . . . 0.0 111.115 179.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -68.79 -52.54 29.19 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.663 0.268 . . . . 0.0 110.754 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.724 ' HB3' HD22 ' A' ' 17' ' ' LEU . 22.6 tp10 -68.76 -22.03 64.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.208 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.578 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -80.08 -46.77 15.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.424 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -53.31 59.09 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 121.581 0.705 . . . . 0.0 110.325 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.44 -0.933 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.166 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.5 mttp . . . . . 0 N--CA 1.467 0.405 0 CA-C-O 120.919 0.39 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' B' ' 109' ' ' VAL . 5.0 tp60 -69.58 115.15 8.49 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.138 0.494 . . . . 0.0 110.211 178.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.874 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.4 OUTLIER -78.1 99.23 6.07 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.778 0.799 . . . . 0.0 109.072 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.693 ' O ' ' HA ' ' B' ' 106' ' ' THR . 1.9 pt -99.34 120.22 48.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 107.022 -1.474 . . . . 0.0 107.022 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.67 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.66 126.21 34.07 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 118.755 -1.178 . . . . 0.0 114.129 -176.661 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -99.45 109.47 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 175.869 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.451 HG22 ' HG3' ' B' ' 104' ' ' ARG . 1.6 p -70.67 94.77 1.04 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.766 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -99.59 -120.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.368 -177.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.626 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 4.7 t70 97.32 11.85 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 CA-C-O 122.088 0.946 . . . . 0.0 109.144 -175.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -170.69 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.386 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.758 ' HB2' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.74 49.97 0.07 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -176.491 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.646 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.6 OUTLIER 52.26 12.59 0.23 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.448 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.873 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -67.17 -57.4 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.535 0.683 . . . . 0.0 112.159 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.788 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 6.6 mt-30 -50.29 -28.71 8.27 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.418 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -62.76 -57.17 11.87 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.416 0.553 . . . . 0.0 111.655 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.935 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 1.0 OUTLIER -47.26 -48.56 24.54 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.89 0.852 . . . . 0.0 111.9 -179.187 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.687 ' CB ' ' HA ' ' A' ' 23' ' ' ASN . 3.5 pttt -79.27 -26.41 42.36 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.682 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.481 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -69.7 -22.96 63.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.005 179.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.513 ' CE2' HD22 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.01 -41.24 13.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.871 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 167.12 -12.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 177.045 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.594 ' O ' ' N ' ' A' ' 24' ' ' ILE . 75.2 t -109.6 80.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-O 120.539 0.209 . . . . 0.0 111.206 -178.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.687 ' HA ' ' CB ' ' A' ' 18' ' ' LYS . 61.6 m-80 -63.4 60.69 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.185 0.517 . . . . 0.0 111.036 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.654 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.1 OUTLIER 46.01 -21.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 178.597 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.66 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.28 -63.8 0.47 Allowed 'General case' 0 C--O 1.245 0.862 0 CA-C-N 118.534 0.606 . . . . 0.0 112.21 -173.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.04 -14.26 72.58 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.29 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.694 ' HG ' HD12 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -65.97 -61.26 2.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 122.343 0.257 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.644 ' O ' ' HG2' ' A' ' 32' ' ' MET . 55.7 t -51.09 -59.21 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.667 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 25.7 p -49.35 -36.81 22.58 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.532 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -74.31 -56.08 5.29 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.424 ' CB ' HG21 ' B' ' 131' ' ' THR . 0.6 OUTLIER -56.05 -44.37 78.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.696 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.833 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 6.6 mmt -52.57 -46.12 66.75 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.707 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.436 ' N ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.831 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -60.49 -51.81 67.87 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -34.08 76.97 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -67.17 -45.39 77.12 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.999 0.428 . . . . 0.0 109.906 177.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.53 -53.56 56.68 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.61 0.719 . . . . 0.0 109.986 178.419 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.444 -0.769 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.123 -178.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.238 0 CA-C-O 120.736 0.303 . . . . 0.0 110.503 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.626 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 14.4 tt0 -125.93 120.16 29.67 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.525 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 7.6 ttm-85 -79.69 116.6 19.97 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.197 -178.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.67 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -113.36 129.77 68.53 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 176.424 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.693 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -129.12 131.7 47.27 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.262 -0.975 . . . . 0.0 112.461 -178.395 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.66 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.96 91.14 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.874 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 23.8 p -69.13 67.54 0.17 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 122.258 1.027 . . . . 0.0 109.735 -178.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 3' ' ' GLN . 15.0 p -99.72 -129.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 113.717 -1.583 . . . . 0.0 110.623 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 0.4 OUTLIER 161.52 -84.84 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.008 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.423 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 45.2 t -102.8 11.25 37.81 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.815 -0.612 . . . . 0.0 112.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.667 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 3.1 t0 -79.24 61.32 3.31 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-N 119.785 1.175 . . . . 0.0 108.105 179.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 29' ' ' SER . 66.0 m 63.33 -22.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.995 -1.002 . . . . 0.0 113.146 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.78 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -47.02 -59.53 3.06 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-O 121.14 0.495 . . . . 0.0 110.852 179.399 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.616 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.8 pt20 -48.49 -38.86 21.23 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.927 -177.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -41.38 74.71 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.343 0.52 . . . . 0.0 112.051 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.833 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -64.62 -45.97 84.62 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.006 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.78 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -74.55 -26.05 59.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 178.782 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -65.46 -34.27 77.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.531 178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.589 ' CE1' HG21 ' B' ' 122' ' ' VAL . 0.1 OUTLIER -88.21 -26.87 22.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.661 179.134 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.586 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 31.1 t70 124.76 61.32 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.589 HG21 ' CE1' ' B' ' 120' ' ' TYR . 24.2 t -156.0 -47.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.507 ' CG ' ' HB3' ' B' ' 118' ' ' LYS . 12.8 m-80 68.69 -112.55 0.11 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 -176.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.643 HG13 ' HE2' ' A' ' 32' ' ' MET . 0.1 OUTLIER -150.02 1.69 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 177.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.421 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.89 -63.44 0.59 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.798 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.37 -30.04 20.39 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.071 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.56 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 10.5 tp -56.51 -61.6 2.3 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.624 0.212 . . . . 0.0 110.441 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.596 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.3 t -48.76 -60.12 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.72 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 2.2 t -49.0 -46.56 44.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -51.51 39.39 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.424 HG21 ' CB ' ' A' ' 31' ' ' THR . 23.5 m -59.6 -36.02 75.46 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.584 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.935 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 1.9 mmt -62.9 -57.9 9.23 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.219 -179.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 1.0 OUTLIER -54.49 -33.46 59.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.512 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.04 -52.35 11.28 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' A' ' 27' ' ' LEU . 78.7 mm-40 -71.25 -20.99 62.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.012 0.434 . . . . 0.0 110.363 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.05 -31.88 34.28 Favored 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 123.122 0.569 . . . . 0.0 110.84 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -80.28 -52.55 7.58 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.58 0.705 . . . . 0.0 110.68 179.535 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 . . . . . 0 N--CA 1.445 -0.705 0 CA-C-N 114.489 -1.232 . . . . 0.0 112.704 -177.616 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.589 ' HE3' ' HA ' ' B' ' 109' ' ' VAL . 1.7 mmmt . . . . . 0 CA--C 1.54 0.567 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.824 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 2.8 tp60 -135.79 138.6 42.77 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.186 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.752 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 8.1 ttm-85 -81.6 98.07 8.17 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.648 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.712 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -97.65 109.62 23.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.753 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.702 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.4 OUTLIER -116.95 121.59 41.86 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.921 -177.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.65 ' CG1' HG12 ' A' ' 9' ' ' VAL . 0.8 OUTLIER -98.96 102.55 13.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 176.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.628 HG23 ' HG3' ' B' ' 104' ' ' ARG . 5.9 p -70.15 67.38 0.3 Allowed 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.804 HG13 ' HB3' ' A' ' 14' ' ' TYR . 13.4 p -97.95 -101.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.687 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.3 OUTLIER 70.91 -61.68 0.47 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 104.195 -2.52 . . . . 0.0 104.195 -174.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -36.58 -70.22 0.1 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 112.83 -1.987 . . . . 0.0 108.804 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.752 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -63.62 -61.54 2.25 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 -175.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.505 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 171.7 37.31 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 120.186 1.357 . . . . 0.0 113.347 -179.328 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.804 ' HB3' HG13 ' A' ' 9' ' ' VAL . 1.2 t80 -81.32 -50.5 9.43 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.44 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.1 mm-40 -49.88 -30.12 9.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -176.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.429 ' CD2' ' OH ' ' A' ' 20' ' ' TYR . 1.8 mt -55.5 -59.06 5.36 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.074 0.397 . . . . 0.0 111.306 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.757 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -55.17 -51.26 67.09 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.546 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -72.25 -25.95 61.82 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.234 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.45 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -58.39 -28.87 65.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.433 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.596 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.4 m-30 -88.09 -42.2 12.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.596 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 149.21 1.82 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 O-C-N 124.294 0.997 . . . . 0.0 112.347 178.455 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.565 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 16.5 t -94.05 71.46 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 121.938 -0.476 . . . . 0.0 112.12 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -61.43 47.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.71 ' CG2' ' HE1' ' B' ' 132' ' ' MET . 0.5 OUTLIER 40.33 -4.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 178.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.526 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -40.86 -55.97 2.33 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 120.066 1.303 . . . . 0.0 110.973 -178.707 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -28.1 24.45 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.499 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.68 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -63.45 -64.33 0.93 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 117.325 0.562 . . . . 0.0 110.143 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.664 HG22 ' CG2' ' A' ' 24' ' ' ILE . 2.7 t -51.3 -61.22 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.656 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 9.3 p -48.68 -27.24 2.74 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.134 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.2 m -83.25 -53.28 5.88 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.438 ' HB ' HD23 ' B' ' 127' ' ' LEU . 10.2 m -55.33 -50.82 68.64 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.642 0.734 . . . . 0.0 109.201 178.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.802 ' HA ' ' HG ' ' B' ' 117' ' ' LEU . 5.3 mmt -48.89 -50.08 36.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.526 -1.216 . . . . 0.0 111.955 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.476 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.93 -47.26 85.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.499 0.19 . . . . 0.0 110.922 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.476 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 72.4 m-20 -58.16 -53.97 52.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.765 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.479 ' HB3' HD21 ' B' ' 117' ' ' LEU . 27.6 mm-40 -69.25 -30.92 69.15 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.399 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.63 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -68.34 -30.64 69.66 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.241 0.543 . . . . 0.0 109.668 177.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.402 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 3.0 mmt180 -82.4 -52.15 7.17 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.922 0.867 . . . . 0.0 110.104 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 113.593 -1.639 . . . . 0.0 114.007 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 11' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.49 0 CA-C-O 120.674 0.273 . . . . 0.0 110.74 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.687 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 9.8 tt0 -135.45 134.64 39.81 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.628 ' HG3' HG23 ' A' ' 8' ' ' THR . 8.6 ttm105 -79.56 116.19 19.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.287 0.565 . . . . 0.0 110.033 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.793 ' HB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -115.4 116.37 52.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.405 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.702 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -121.05 127.16 51.44 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -175.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.538 ' CG2' ' O ' ' B' ' 107' ' ' VAL . 0.5 OUTLIER -103.73 95.64 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.752 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 52.8 p -70.9 91.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.938 -1.101 . . . . 0.0 109.93 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.773 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 4.4 m -132.4 -30.17 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -177.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.824 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 7.9 t70 42.38 -88.1 0.01 OUTLIER 'General case' 0 C--N 1.343 0.302 0 CA-C-O 122.451 1.12 . . . . 0.0 108.721 -177.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.577 ' N ' ' O ' ' B' ' 109' ' ' VAL . 2.0 m -60.81 -18.31 54.66 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 112.542 -2.117 . . . . 0.0 114.991 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.773 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -79.5 62.3 3.78 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 120.194 1.361 . . . . 0.0 110.374 -178.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 29' ' ' SER . 17.0 m 57.98 -19.73 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.712 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -47.08 -54.24 10.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.496 0.665 . . . . 0.0 110.663 179.301 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.616 ' HG2' ' O ' ' B' ' 110' ' ' ASP . 3.7 pt20 -50.18 -43.85 52.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.717 -1.128 . . . . 0.0 112.614 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.63 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -56.56 -45.16 81.41 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 120.874 0.369 . . . . 0.0 111.864 -179.476 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.802 ' HG ' ' HA ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -55.14 -47.62 74.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.725 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -79.25 -33.14 43.8 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.205 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.434 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -57.91 -31.15 66.51 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.914 178.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.638 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.67 -43.33 11.4 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.447 178.976 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.638 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 151.55 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 177.026 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.555 ' O ' ' HB3' ' B' ' 117' ' ' LEU . 88.6 t -162.07 88.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.725 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -61.93 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.716 HG23 ' HE3' ' A' ' 32' ' ' MET . 0.1 OUTLIER -151.12 -0.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 178.453 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 8.7 t -38.71 -62.39 0.62 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.69 0.281 . . . . 0.0 110.63 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.99 -28.62 30.77 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.356 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.694 ' CD1' ' SD ' ' A' ' 32' ' ' MET . 1.2 tt -62.61 -61.91 2.1 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.845 0.322 . . . . 0.0 110.902 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.623 ' O ' ' HG2' ' B' ' 132' ' ' MET . 3.9 t -53.09 -61.35 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.822 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.752 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 16.1 p -49.56 -45.58 47.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.5 OUTLIER -83.57 -50.68 8.0 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.806 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.667 ' HB ' HD21 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -54.47 -34.52 61.71 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.757 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.6 mmt -66.55 -52.52 44.78 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.054 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -42.06 61.35 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 122.143 -0.348 . . . . 0.0 111.191 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.3 m-20 -64.38 -55.68 19.42 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.858 0.361 . . . . 0.0 110.173 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -23.06 65.65 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.693 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -72.07 -40.14 68.5 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -52.85 14.12 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.842 0.83 . . . . 0.0 109.521 177.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.445 -0.684 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.027 -177.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.433 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 4.2 mpp? . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.449 0.166 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.715 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 17.9 mmtm 71.82 140.73 0.05 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.834 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.493 ' O ' ' N ' ' B' ' 109' ' ' VAL . 56.0 tt0 -112.35 120.4 41.56 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.205 0.526 . . . . 0.0 111.858 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.736 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.4 OUTLIER -77.9 109.1 11.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.999 0.904 . . . . 0.0 111.798 -179.013 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.754 HG23 ' CD2' ' B' ' 114' ' ' TYR . 0.4 OUTLIER -110.65 117.16 54.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.379 178.514 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.861 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -133.1 134.37 44.17 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 118.262 -1.375 . . . . 0.0 114.48 -177.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.446 HG13 ' HB ' ' B' ' 124' ' ' ILE . 1.4 m -99.72 111.68 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.558 ' CG2' ' NE ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -71.6 67.85 0.56 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.013 -0.43 . . . . 0.0 111.975 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.469 ' HB ' ' HB2' ' A' ' 12' ' ' ASP . 3.2 m -99.03 -120.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.721 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.667 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 6.1 t70 157.61 -85.09 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.681 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -102.04 12.36 36.97 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 119.237 -0.411 . . . . 0.0 112.094 178.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.55 ' C ' ' H ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -73.43 60.39 0.63 Allowed 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.355 0.98 . . . . 0.0 108.47 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.54 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 48.8 m 61.52 -23.54 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.728 ' CG ' HG23 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -48.5 -60.63 2.53 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 123.173 0.589 . . . . 0.0 111.07 179.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.681 ' HG2' ' HA ' ' A' ' 11' ' ' SER . 0.8 OUTLIER -48.95 -36.94 18.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.804 -176.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 19' ' ' ALA . 0.2 OUTLIER -59.34 -49.52 77.5 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.766 ' HG ' ' HG3' ' B' ' 132' ' ' MET . 0.5 OUTLIER -51.57 -56.33 14.11 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.417 0.627 . . . . 0.0 111.653 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.604 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 4.7 pttt -70.43 -28.38 64.99 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.476 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . . . -64.72 -26.0 68.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.677 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.605 ' CZ ' ' HB3' ' A' ' 67' ' ' ASP . 0.2 OUTLIER -87.76 -41.18 13.48 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.98 178.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.558 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 157.18 35.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 177.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.597 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -167.56 96.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 122.149 0.975 . . . . 0.0 113.527 -179.599 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.604 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 34.1 m-80 -67.26 66.23 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.134 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.773 ' CG2' HG21 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 36.34 -6.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -38.36 -61.74 0.66 Allowed 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.569 1.077 . . . . 0.0 111.559 -177.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.83 -33.27 34.2 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.294 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.704 ' CD2' ' HG ' ' A' ' 17' ' ' LEU . 22.4 tp -62.36 -61.97 2.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 117.367 0.584 . . . . 0.0 111.707 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.773 HG21 ' CG2' ' A' ' 24' ' ' ILE . 17.6 t -46.15 -68.54 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 O-C-N 123.381 0.425 . . . . 0.0 110.204 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.578 ' CB ' ' CB ' ' B' ' 112' ' ' ASP . 2.9 m -49.96 -37.01 30.2 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -64.13 -51.41 64.06 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.508 HG22 ' OG1' ' B' ' 131' ' ' THR . 28.2 m -60.99 -39.85 91.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.057 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.821 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 6.0 mmt -58.41 -57.77 11.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.817 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.423 ' HA ' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -52.79 -35.4 56.69 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.998 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.408 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -70.65 -55.87 7.75 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.61 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.622 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -69.75 -17.53 63.44 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 177.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.687 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -75.83 -50.54 14.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -56.49 10.03 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.12 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -62.72 -47.82 81.9 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.47 -179.016 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.692 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 37.44 37.95 0.12 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.04 179.565 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.435 ' HD2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -177.98 109.99 0.06 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.506 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 79.59 96.19 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 175.52 4.55 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.927 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.22 118.45 22.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.093 0.473 . . . . 0.0 111.671 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -122.21 176.23 5.96 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.75 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.571 ' HD2' ' CD ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -165.2 135.2 3.66 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.978 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -160.42 104.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -108.73 -67.05 1.0 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -133.14 138.0 46.47 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.599 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.582 ' C ' ' HG3' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -72.12 79.52 0.95 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.012 0.434 . . . . 0.0 110.842 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.582 ' HG3' ' C ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 41.06 -94.77 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.953 -179.166 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.12 22.28 59.42 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 tpp 72.25 -53.12 0.7 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 122.622 0.369 . . . . 0.0 111.844 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.8 m -78.02 142.54 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -131.12 -168.67 2.04 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.96 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -152.6 -61.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.525 ' HB1' ' HE2' ' A' ' 70' ' ' LYS . . . 68.1 97.81 0.06 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.291 0.567 . . . . 0.0 111.362 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.43 -27.43 12.41 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.929 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -160.88 -170.73 2.82 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.324 0.583 . . . . 0.0 112.443 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.456 ' HB ' ' O ' ' B' ' 146' ' ' VAL . 1.3 pp -96.69 149.64 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.217 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.422 ' HG2' ' HE3' ' A' ' 45' ' ' LYS . 2.1 tt0 -144.53 -56.51 0.35 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.704 ' HA ' ' HB3' ' B' ' 147' ' ' GLU . 2.0 mtt -149.67 153.39 36.92 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.554 0.216 . . . . 0.0 111.306 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.471 ' ND2' ' HG3' ' B' ' 147' ' ' GLU . 10.7 p30 -110.62 156.42 20.99 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.782 0.325 . . . . 0.0 110.96 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.416 ' O ' ' CB ' ' A' ' 64' ' ' SER . . . -136.36 -44.07 0.1 OUTLIER Glycine 0 C--N 1.337 0.589 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.975 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 63' ' ' GLY . 6.1 t 84.6 -166.45 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.563 0.345 . . . . 0.0 110.772 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 54.99 -102.33 0.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.595 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -158.02 64.47 0.46 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.369 0.604 . . . . 0.0 111.448 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.605 ' HB3' ' CZ ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -155.38 -61.59 0.11 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.231 -179.246 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 61.18 173.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.529 ' HA ' ' HG2' ' B' ' 138' ' ' ARG . 0.6 OUTLIER -132.53 87.2 2.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.021 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.525 ' HE2' ' HB1' ' A' ' 56' ' ' ALA . 19.0 mtpt -96.31 167.4 11.21 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.994 0.425 . . . . 0.0 111.605 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.453 ' O ' ' HB3' ' A' ' 72' ' ' TRP . 8.7 p-10 -93.7 116.2 28.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.172 0.51 . . . . 0.0 111.569 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.453 ' HB3' ' O ' ' A' ' 71' ' ' ASP . 24.9 p-90 . . . . . 0 C--O 1.251 1.15 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.263 179.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 120.196 0.046 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp -76.44 157.46 32.21 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.101 0.251 . . . . 0.0 110.486 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.667 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 4.9 tt0 -113.59 116.51 29.62 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.278 0.561 . . . . 0.0 111.753 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.619 ' NH1' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.07 113.92 17.6 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.653 178.34 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.728 HG23 ' CG ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -106.05 122.65 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.755 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.861 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -125.45 123.78 39.99 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.469 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.584 HG12 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.8 104.1 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 173.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.736 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 55.2 p -70.24 89.79 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.826 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.668 HG23 ' CB ' ' B' ' 114' ' ' TYR . 3.5 t -82.75 -131.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.0 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.715 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 22.3 t0 86.34 -3.39 0.73 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -175.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.5 m -137.04 -59.27 0.7 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.514 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.578 ' CB ' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -46.15 -91.6 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.415 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.5 OUTLIER 179.11 36.53 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.528 -0.733 . . . . 0.0 110.63 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.754 ' CD2' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -82.24 -46.16 14.07 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -178.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.528 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.82 -34.73 12.97 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.687 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -59.85 -56.93 15.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.424 0.556 . . . . 0.0 112.288 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.821 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -53.46 -40.61 65.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 119.856 -0.737 . . . . 0.0 111.495 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.658 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -79.15 -26.89 42.72 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 0.0 110.196 178.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -62.03 -29.82 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.738 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.692 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -88.0 -44.07 11.27 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.708 178.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.683 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 t0 160.21 15.82 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 177.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.466 ' O ' ' CD2' ' B' ' 117' ' ' LEU . 60.9 t -154.28 93.35 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-N 118.848 0.749 . . . . 0.0 112.938 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.575 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.3 m120 -56.58 -97.64 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.672 HG13 ' HE2' ' A' ' 32' ' ' MET . 0.2 OUTLIER -142.73 -1.28 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.9 OUTLIER -39.27 -64.47 0.46 Allowed 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.202 -177.823 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.22 -26.63 35.99 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 121.1 -0.572 . . . . 0.0 112.449 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.7 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.79 -61.09 2.75 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.065 0.46 . . . . 0.0 110.641 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.736 HG13 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -49.03 -66.38 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.965 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.499 ' N ' HG13 ' B' ' 128' ' ' VAL . 94.9 p -49.27 -35.22 17.23 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 29.0 m -70.76 -53.72 14.43 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.508 ' OG1' HG22 ' A' ' 31' ' ' THR . 0.6 OUTLIER -62.55 -41.0 98.61 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.111 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.766 ' HG3' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -56.72 -51.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.325 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.54 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.81 -39.3 71.16 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 121.024 -0.271 . . . . 0.0 111.09 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -47.46 65.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.562 ' CB ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.99 -27.82 68.42 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.025 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' B' ' 139' ' ' LEU . . . -74.13 -52.33 12.88 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 122.919 0.487 . . . . 0.0 110.607 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -50.49 66.87 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.417 0.627 . . . . 0.0 110.724 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.571 ' CD ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.73 -32.97 64.12 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.964 -1.016 . . . . 0.0 112.561 -177.782 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.571 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -10.49 100.69 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.406 ' N ' ' O ' ' A' ' 67' ' ' ASP . 9.8 tpp180 -153.99 76.39 1.06 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.13 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -33.64 112.75 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.166 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -167.34 -173.53 2.29 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.224 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -160.55 175.25 12.92 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.952 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.417 ' O ' ' HE3' ' B' ' 145' ' ' LYS . 1.2 m-90 63.05 71.87 0.5 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.28 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.417 ' HE3' ' O ' ' B' ' 144' ' ' TRP . 0.2 OUTLIER -150.62 138.05 19.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.456 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 3.2 p -106.49 173.39 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.849 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.704 ' HB3' ' HA ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -137.06 163.07 31.63 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.213 0.53 . . . . 0.0 112.222 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 179.36 53.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.987 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -157.95 157.87 33.9 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.83 0.348 . . . . 0.0 111.492 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -93.13 158.4 15.79 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.227 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -125.67 96.3 0.49 Allowed Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.327 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' MET . . . . . 0.548 ' O ' ' HB ' ' B' ' 153' ' ' VAL . 2.2 ttt -110.78 -141.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.071 0.148 . . . . 0.0 111.024 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . 0.548 ' HB ' ' O ' ' B' ' 152' ' ' MET . 50.7 t 80.96 143.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.06 0.544 . . . . 0.0 111.579 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.528 ' HB3' ' HB2' ' B' ' 172' ' ' TRP . 4.9 mp0 -132.68 164.52 26.55 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.425 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.405 ' O ' HG12 ' B' ' 155' ' ' VAL . 13.0 p 178.72 54.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.509 0.671 . . . . 0.0 111.803 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.503 ' HB3' ' C ' ' B' ' 172' ' ' TRP . . . -73.87 159.03 33.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.965 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.89 143.67 26.39 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.174 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -106.39 110.27 22.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.848 0.356 . . . . 0.0 111.201 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -174.49 -41.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.676 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -83.57 -77.94 0.24 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.377 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 4.4 ttm -178.64 -67.94 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.429 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 49.54 59.41 4.51 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.153 0.502 . . . . 0.0 111.986 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -84.2 61.86 4.66 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.034 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 25.2 p -98.55 84.42 3.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 120.93 0.395 . . . . 0.0 110.513 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.77 129.67 56.73 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.906 -179.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.551 ' HB1' ' HB3' ' B' ' 121' ' ' ASP . . . -162.35 -116.86 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.694 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -70.7 83.09 0.62 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.909 0.385 . . . . 0.0 111.504 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 37.7 46.44 0.72 Allowed 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.801 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -101.78 163.61 12.17 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.246 0.546 . . . . 0.0 112.024 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.81 165.76 22.64 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.665 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -60.53 166.88 2.89 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.003 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.528 ' HB2' ' HB3' ' B' ' 154' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.978 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.542 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.88 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.163 0 C3'-C2'-C1' 105.346 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.773 H2'' " O5'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 105.978 2.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.773 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 104.274 1.124 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.477 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.997 0 C1'-O4'-C4' 107.478 -1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.525 ' H8 ' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C3'-C2'-C1' 105.199 1.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.581 ' H73' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.513 0 C4'-C3'-C2' 103.76 0.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C3'-C2'-C1' 105.892 2.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.47 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C3'-C2'-C1' 101.434 -0.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.47 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 104.311 1.151 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.501 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.978 0 C3'-C2'-C1' 105.125 1.732 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.501 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.708 0 N19-C1'-C2' 113.131 -0.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 C1'-O4'-C4' 110.478 0.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-C2' 107.074 0.886 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.889 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 O4'-C1'-C2' 107.224 1.022 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.635 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 102.046 -0.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.678 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.637 -0.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.678 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.864 0 C4'-C3'-C2' 104.537 1.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.625 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.92 0 C4'-C3'-C2' 104.813 1.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.625 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.837 0 C1'-O4'-C4' 106.839 -2.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.514 ' C8 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C3'-C2'-C1' 104.484 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.516 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.815 0 C4'-C3'-C2' 104.691 1.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.518 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-C2' 107.061 0.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.518 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.061 0 C1'-O4'-C4' 107.18 -1.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.433 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C4'-C3'-C2' 104.532 1.332 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.404 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.691 0 C4'-C3'-C2' 104.427 1.227 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 102.037 -0.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpp? . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.312 0.101 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.16 129.1 9.5 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.111 0.482 . . . . 0.0 111.71 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.582 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 34.4 tp60 -111.36 119.48 38.99 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.742 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.788 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 9.0 ttp-105 -78.17 107.92 11.1 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.327 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.651 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.8 OUTLIER -109.33 116.47 52.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.128 178.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.638 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -121.51 124.03 43.43 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 119.8 -0.76 . . . . 0.0 112.921 -177.414 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.619 HG21 ' HA ' ' B' ' 125' ' ' SER . 0.1 OUTLIER -101.69 108.44 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.492 HG22 ' HG3' ' B' ' 104' ' ' ARG . 11.4 p -70.5 88.73 0.68 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.156 0.503 . . . . 0.0 110.54 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.737 HG23 ' CD1' ' A' ' 14' ' ' TYR . 15.8 m -81.9 -146.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.852 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.673 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 4.3 t70 87.82 -10.97 0.52 Allowed 'General case' 0 C--N 1.353 0.721 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -176.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 t -116.53 -69.84 0.83 Allowed 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.373 177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.748 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -51.68 -86.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.664 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.615 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 0.4 OUTLIER 178.77 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 120.416 1.462 . . . . 0.0 112.997 -178.955 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.831 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -82.96 -41.06 19.25 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.33 0.652 . . . . 0.0 112.615 179.429 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.569 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 1.5 mp0 -49.11 -42.91 40.74 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -175.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.584 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -55.26 -42.71 73.86 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.469 1.031 . . . . 0.0 112.445 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.673 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.37 -55.12 27.08 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.108 -179.079 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -67.77 -26.0 65.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.495 0.664 . . . . 0.0 110.015 178.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -61.45 -31.77 71.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.594 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.666 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.5 -42.52 12.05 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 118.396 -0.811 . . . . 0.0 109.995 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.561 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 152.88 26.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.499 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.428 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.3 t -156.43 91.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 O-C-N 122.106 -0.371 . . . . 0.0 111.904 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.404 ' HB3' HD12 ' A' ' 24' ' ' ILE . 8.7 m-20 -54.78 -92.01 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.685 HG21 HG21 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -153.84 1.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 115.874 1.805 . . . . 0.0 115.874 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.618 ' HA ' HG21 ' B' ' 107' ' ' VAL . 1.3 p -38.97 -63.72 0.51 Allowed 'General case' 0 C--O 1.246 0.915 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.236 -177.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.86 -23.39 52.89 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.443 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.676 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 0.2 OUTLIER -65.12 -60.88 2.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.825 0.313 . . . . 0.0 111.111 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.664 HG22 HG23 ' A' ' 24' ' ' ILE . 15.7 t -50.44 -65.28 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.401 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.653 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 12.9 p -48.62 -36.1 15.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.3 m -78.04 -52.28 9.02 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.51 -41.15 93.75 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.605 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.763 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 6.2 mmt -54.87 -47.02 74.76 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.504 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.4 tt0 -60.46 -52.6 64.5 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.7 0.286 . . . . 0.0 110.805 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -48.1 76.41 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.014 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.531 ' HG3' ' HB2' ' B' ' 168' ' ' GLU . 0.0 OUTLIER -69.8 -33.07 71.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.147 178.02 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.526 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -64.56 -45.71 85.89 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.498 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -62.26 -51.33 68.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.332 177.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.451 ' O ' ' C ' ' A' ' 39' ' ' LEU . 2.0 tpm_? -58.34 -43.96 88.5 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.429 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.63 HD13 ' HB3' ' B' ' 120' ' ' TYR . 0.4 OUTLIER -13.94 110.91 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.835 0.854 . . . . 0.0 112.503 179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.412 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -134.4 -85.3 0.42 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 168.88 162.1 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.84 0.352 . . . . 0.0 111.553 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.59 93.27 0.9 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.094 0.473 . . . . 0.0 110.914 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 3.6 tpm_? -103.82 -12.86 16.66 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.883 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.2 t90 69.5 -59.05 0.5 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.443 ' O ' ' HB ' ' A' ' 46' ' ' VAL . 0.6 OUTLIER -140.59 149.77 42.77 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.345 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.443 ' HB ' ' O ' ' A' ' 45' ' ' LYS . 36.7 t 84.0 111.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.914 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -109.81 -162.63 0.81 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.613 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -166.07 138.86 4.05 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.793 0.33 . . . . 0.0 111.609 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.53 59.89 0.85 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.356 0.598 . . . . 0.0 110.828 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -106.88 58.71 0.63 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.658 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -174.16 -36.56 0.04 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 120.478 -0.867 . . . . 0.0 114.37 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.6 mmt 72.23 173.9 0.3 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 117.332 0.566 . . . . 0.0 111.229 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.3 m -120.39 -169.08 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.441 ' HG2' ' CZ3' ' A' ' 72' ' ' TRP . 11.5 mt-10 72.59 141.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.282 0.563 . . . . 0.0 111.43 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.537 HG12 ' CB ' ' A' ' 72' ' ' TRP . 11.4 p -134.96 31.04 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.021 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.56 61.81 0.24 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.247 0.546 . . . . 0.0 110.31 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.478 ' NH1' ' HA ' ' A' ' 55' ' ' VAL . 31.3 ptt-85 -164.22 44.17 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.246 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.78 -66.76 0.14 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.648 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -151.32 141.69 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 120.929 0.395 . . . . 0.0 111.371 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -75.78 167.42 21.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.331 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.99 127.01 30.1 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.232 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -84.9 -53.05 5.57 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.581 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.52 112.89 1.18 Allowed Glycine 0 C--N 1.336 0.582 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.124 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.9 t -137.99 153.21 49.44 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 111.709 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -85.72 -9.75 56.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.182 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -126.56 97.24 4.95 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.531 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' A' ' 66' ' ' ALA . 45.2 t0 82.92 143.29 0.07 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.423 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -91.39 -67.45 0.85 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.981 179.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.19 -178.87 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.522 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.14 96.86 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.39 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -58.37 -57.05 14.61 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.575 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.537 ' CB ' HG12 ' A' ' 55' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.735 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.433 ' O ' ' C ' ' B' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -27.37 119.57 0.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 O-C-N 123.567 0.542 . . . . 0.0 112.319 -178.7 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.47 ' HB3' HG22 ' A' ' 9' ' ' VAL . 24.9 tt0 -98.67 114.11 26.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.651 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.525 ' NE ' ' O4 ' ' D' ' 193' ' ' ' DT' . 14.7 ttm-85 -78.29 105.35 9.47 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.401 0.619 . . . . 0.0 112.233 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.703 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -106.63 126.4 62.47 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 176.293 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.651 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -124.44 127.81 48.07 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 119.94 -0.704 . . . . 0.0 112.154 -177.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.618 HG21 ' HA ' ' A' ' 25' ' ' SER . 1.2 t -100.14 93.85 3.2 Favored 'Isoleucine or valine' 0 C--N 1.346 0.44 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.788 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 73.3 p -70.62 66.87 0.35 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.811 0.815 . . . . 0.0 109.434 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.705 ' CG2' ' HB2' ' B' ' 112' ' ' ASP . 7.5 p -90.55 -124.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 CA-C-N 113.905 -1.498 . . . . 0.0 108.816 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.582 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 21.7 t70 158.41 -92.22 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.612 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 26.5 t -97.61 9.57 42.16 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.226 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.705 ' HB2' ' CG2' ' B' ' 109' ' ' VAL . 52.8 m-20 -80.37 68.91 6.7 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 117.794 -1.563 . . . . 0.0 108.242 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.712 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 61.97 -24.3 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.167 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.629 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.5 OUTLIER -48.69 -62.36 1.55 Allowed 'General case' 0 C--N 1.348 0.506 0 CA-C-O 120.895 0.379 . . . . 0.0 111.313 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.612 ' HG2' ' HA ' ' B' ' 111' ' ' SER . 0.8 OUTLIER -49.85 -34.56 20.26 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.134 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.2 OUTLIER -59.75 -56.1 26.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.79 ' HG ' ' CE2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER -54.04 -44.46 71.05 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 120.412 -0.515 . . . . 0.0 112.226 -177.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.648 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER -70.57 -25.66 63.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 178.664 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' B' ' 116' ' ' LEU . . . -63.88 -28.02 69.56 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.02 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.79 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -88.35 -41.4 12.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.749 -1.119 . . . . 0.0 110.715 178.726 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.639 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 m-20 146.42 45.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.469 ' CG2' ' CB ' ' B' ' 166' ' ' ALA . 25.7 t -150.9 -43.85 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.648 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 5.2 m-80 73.06 -121.09 0.05 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.681 HG13 ' HE2' ' A' ' 32' ' ' MET . 0.2 OUTLIER -138.3 0.26 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 C-N-CA 119.515 -0.874 . . . . 0.0 113.308 177.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.619 ' HA ' HG21 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.65 -63.14 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.094 0.473 . . . . 0.0 109.784 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.569 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -88.21 -33.98 10.13 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.329 178.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.625 HD22 HD21 ' B' ' 117' ' ' LEU . 9.1 tp -54.65 -62.35 1.71 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 117.149 0.475 . . . . 0.0 111.168 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.724 ' CG1' ' SD ' ' B' ' 132' ' ' MET . 1.9 t -52.07 -62.34 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.313 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.748 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 20.9 p -52.46 -44.31 65.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.569 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -73.22 -49.14 29.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' B' ' 135' ' ' GLU . 2.8 m -53.72 -52.25 60.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.831 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 8.9 mtt -55.37 -53.77 51.98 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.615 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -52.58 -42.59 64.65 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.443 179.519 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -65.64 -54.45 27.48 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.54 ' O ' ' HG ' ' B' ' 139' ' ' LEU . 6.7 mm-40 -60.65 -28.05 68.28 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.644 ' HA ' ' CD1' ' B' ' 139' ' ' LEU . . . -76.02 -50.91 13.51 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.602 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -49.16 62.51 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.964 0.888 . . . . 0.0 109.529 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' B' ' 140' ' ' ARG . 3.6 mmt180 -69.96 -16.78 63.25 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.579 -1.646 . . . . 0.0 113.412 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.644 ' CD1' ' HA ' ' B' ' 136' ' ' ALA . 47.3 mt -43.48 82.56 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER 171.83 105.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.71 179.732 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 68.66 0.26 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.024 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.73 -49.49 10.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.847 0.356 . . . . 0.0 110.262 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -136.52 -176.82 4.47 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.09 38.79 0.36 Allowed 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 120.687 0.28 . . . . 0.0 110.973 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? 69.92 -174.72 0.19 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.666 0.386 . . . . 0.0 110.799 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 93.7 t -103.64 -71.8 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 52.83 -111.18 0.58 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.818 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 12.0 t30 66.63 121.11 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.944 0.402 . . . . 0.0 111.531 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.87 60.37 0.1 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.211 0.529 . . . . 0.0 110.898 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.06 -74.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.998 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.14 -60.65 0.15 Allowed Glycine 0 C--N 1.337 0.605 0 C-N-CA 121.42 -0.419 . . . . 0.0 113.619 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' MET . . . . . 0.43 ' O ' ' CG2' ' B' ' 153' ' ' VAL . 0.0 OUTLIER 65.09 75.17 0.37 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.667 0.387 . . . . 0.0 111.304 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . 0.43 ' CG2' ' O ' ' B' ' 152' ' ' MET . 1.3 m 61.56 -164.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.782 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.584 ' HA ' ' HE3' ' B' ' 172' ' ' TRP . 0.9 OUTLIER -87.43 154.07 20.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.578 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.431 HG21 ' CE2' ' B' ' 172' ' ' TRP . 3.7 m -141.45 27.01 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.516 ' CB ' ' HB3' ' B' ' 171' ' ' ASP . . . -87.16 137.48 32.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.834 0.35 . . . . 0.0 110.57 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . 0.466 ' HA ' ' HD3' ' B' ' 157' ' ' ARG . 0.0 OUTLIER -138.76 -165.51 1.84 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.732 0.301 . . . . 0.0 111.798 -179.105 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -62.61 67.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' B' ' 157' ' ' ARG . 9.2 mt -142.86 -54.79 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.611 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -112.26 -178.68 3.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.424 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.25 -80.22 0.58 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . 0.444 ' HB3' ' HA ' ' B' ' 171' ' ' ASP . 0.1 OUTLIER 67.9 35.95 3.63 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 179.869 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -155.75 177.9 32.61 Favored Glycine 0 C--N 1.336 0.582 0 CA-C-N 116.446 -0.343 . . . . 0.0 112.366 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.487 ' HB3' ' CD ' ' B' ' 168' ' ' GLU . 10.6 t -137.0 -155.35 0.61 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.247 0.523 . . . . 0.0 112.293 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.54 22.22 15.7 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -178.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.469 ' CB ' ' CG2' ' B' ' 122' ' ' VAL . . . -128.03 -98.65 0.37 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.171 -0.33 . . . . 0.0 111.56 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -138.01 55.43 1.77 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.128 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.531 ' HB2' ' HG3' ' A' ' 35' ' ' GLU . 1.1 pm0 -140.6 93.49 2.62 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.216 0.531 . . . . 0.0 110.85 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -138.47 125.67 21.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.445 ' CB ' ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -145.35 -46.86 0.22 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.487 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.516 ' HB3' ' CB ' ' B' ' 156' ' ' ALA . 0.6 OUTLIER 64.81 -83.58 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.193 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.584 ' HE3' ' HA ' ' B' ' 154' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.746 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.884 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C3'-C2'-C1' 101.848 -0.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.6 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 101.348 -0.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.6 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C3'-C2'-C1' 104.643 1.388 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.473 ' C2 ' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.986 0 C1'-O4'-C4' 107.07 -1.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.491 ' N2 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.806 0 C4'-C3'-C2' 104.734 1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.577 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.75 0 C4'-C3'-C2' 104.44 1.24 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.577 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C3'-C2'-C1' 104.916 1.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.716 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 N19-C1'-C2' 115.212 0.632 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.716 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.567 0 C3'-C2'-C1' 104.572 1.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.724 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.899 0 C3'-C2'-C1' 105.384 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.724 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 O4'-C1'-C2' 107.163 0.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.492 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C1'-O4'-C4' 110.636 0.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.403 1.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.89 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O4'-C1'-C2' 107.025 0.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 107.004 0.822 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.537 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C4'-C3'-C2' 102.461 -0.739 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.537 ' C8 ' " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 C1'-O4'-C4' 110.434 0.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.52 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.404 -1.265 0 C1'-O4'-C4' 107.553 -1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.504 ' C2 ' ' C6 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 C4'-C3'-C2' 104.221 1.021 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.504 ' C6 ' ' C2 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 C3'-C2'-C1' 105.356 1.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.525 ' O4 ' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C4'-C3'-C2' 104.53 1.33 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.471 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-C2' 106.984 0.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.471 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.018 0 C1'-O4'-C4' 106.965 -1.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.18 1.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 O4'-C1'-C2' 105.014 -0.987 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C4'-C3' 106.026 0.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 120.359 0.123 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.502 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -163.04 175.15 11.4 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.905 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.2 OUTLIER -123.93 102.12 7.61 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.405 0.622 . . . . 0.0 111.526 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.863 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.9 ttm105 -79.55 111.32 15.7 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.546 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.752 HG21 ' CD2' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -110.26 122.79 65.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.199 179.464 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.678 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.63 131.93 43.61 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.406 -0.918 . . . . 0.0 112.687 -177.788 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.606 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.4 OUTLIER -100.19 112.17 31.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.053 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.488 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 7.0 p -70.85 81.56 0.64 Allowed 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.923 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.671 ' CG2' ' CD2' ' A' ' 14' ' ' TYR . 7.0 m -77.39 -137.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.156 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.69 ' HB2' ' HB2' ' B' ' 103' ' ' GLN . 36.9 t70 84.88 -11.47 0.78 Allowed 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -122.13 -63.11 1.32 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.187 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.622 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 0.8 OUTLIER -48.16 -97.94 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.197 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.574 ' O ' ' HB2' ' B' ' 132' ' ' MET . 4.0 m -174.23 41.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.144 -0.972 . . . . 0.0 111.814 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.687 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -80.6 -41.59 23.7 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.557 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.0 -46.36 43.78 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -175.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.812 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -53.55 -44.82 69.55 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.574 0.625 . . . . 0.0 112.237 -179.351 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.842 HD13 ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -63.5 -48.28 78.25 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.444 0.64 . . . . 0.0 111.626 -179.826 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.565 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -76.93 -29.97 55.9 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.145 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.517 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -29.71 70.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.764 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.638 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.82 -43.71 11.03 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.61 179.012 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.638 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 155.51 37.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.581 ' HB ' ' CD2' ' A' ' 17' ' ' LEU . 47.6 t -150.82 86.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 121.115 -0.991 . . . . 0.0 113.062 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.526 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -76.59 54.38 0.95 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.164 0.506 . . . . 0.0 111.069 179.081 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.665 HG23 ' HE3' ' B' ' 132' ' ' MET . 0.7 OUTLIER 39.55 -4.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 119.339 3.089 . . . . 0.0 119.339 178.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.639 ' HA ' HG21 ' B' ' 107' ' ' VAL . 0.0 OUTLIER -38.69 -63.88 0.48 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 120.267 1.394 . . . . 0.0 110.578 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.502 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.35 -33.38 11.81 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.923 -0.655 . . . . 0.0 111.862 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.585 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 0.2 OUTLIER -52.61 -61.64 2.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.919 0.39 . . . . 0.0 110.764 178.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.707 HG13 ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -53.18 -66.31 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.862 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.633 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 18.5 m -50.97 -41.74 59.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.502 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.46 -54.33 11.0 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.1 m -54.12 -39.3 66.31 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.78 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.785 ' HE2' HG12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.46 -51.31 58.13 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.178 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -48.6 -33.37 9.67 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.992 0.814 . . . . 0.0 110.16 179.69 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.3 -57.18 9.07 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.86 -10.34 59.51 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.603 178.537 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HB2' ' HB3' ' B' ' 116' ' ' LEU . . . -88.49 -28.95 20.49 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.11 -54.0 5.64 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.641 0.734 . . . . 0.0 109.708 179.066 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -33.01 50.22 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.188 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.607 HD22 ' CD2' ' B' ' 120' ' ' TYR . 1.3 mp 42.77 60.95 2.26 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.609 0.763 . . . . 0.0 112.547 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.651 ' HA ' ' NE ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -162.94 70.42 0.26 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.73 178.867 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.15 16.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.36 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 65.6 -67.12 0.14 Allowed 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.11 114.21 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.831 0.348 . . . . 0.0 111.392 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -101.61 133.02 46.95 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.928 0.394 . . . . 0.0 111.166 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -147.03 154.79 41.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.124 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.8 m -106.09 170.4 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.006 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.04 -67.9 0.72 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.793 0.33 . . . . 0.0 111.352 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -106.96 174.43 5.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.927 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -81.61 -79.81 0.16 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' B' ' 144' ' ' TRP . 9.7 mp0 57.94 176.26 0.06 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.171 0.51 . . . . 0.0 112.137 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 52' ' ' MET . . . 160.66 -99.98 0.18 Allowed Glycine 0 C--N 1.337 0.611 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.978 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.526 ' SD ' ' HG3' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 83.07 168.74 0.11 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.06 0.544 . . . . 0.0 111.865 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.1 t -81.71 167.29 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.802 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -64.0 -178.6 0.34 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.591 ' HA ' ' CD1' ' A' ' 72' ' ' TRP . 0.8 OUTLIER -169.78 41.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 179.402 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -49.49 -53.33 23.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -66.79 0.28 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.476 0.31 . . . . 0.0 111.724 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.0 t80 178.41 -71.34 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.559 0.218 . . . . 0.0 111.396 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.4 mt -147.48 125.98 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.741 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -129.87 -73.18 0.56 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.094 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 16.9 mtt -136.65 146.03 45.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -71.96 138.93 48.39 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 111.207 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 145.96 84.05 0.06 OUTLIER Glycine 0 C--N 1.334 0.467 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.591 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 86.2 p -79.75 85.92 5.39 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 111.784 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -95.79 -46.7 6.47 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.01 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.27 23.81 11.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.232 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 62.88 178.83 0.14 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.663 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -156.45 121.57 4.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.422 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -104.51 -98.74 0.32 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptt 179.25 133.84 0.09 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.484 0.183 . . . . 0.0 111.158 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.78 120.83 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.241 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.591 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 47.7 p-90 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.317 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 11.0 mmm . . . . . 0 N--CA 1.496 1.841 0 CA-C-O 120.989 0.423 . . . . 0.0 111.673 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' A' ' 8' ' ' THR . 4.3 mmtm -149.22 125.85 11.04 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.69 ' HB2' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -94.87 113.58 25.33 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.0 0.428 . . . . 0.0 112.012 -179.473 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.585 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.46 97.81 7.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.942 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.63 ' O ' ' HA ' ' A' ' 6' ' ' THR . 8.9 pt -100.04 113.77 36.51 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.958 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.678 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -117.98 119.32 34.43 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.639 HG21 ' HA ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -100.19 102.78 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 174.082 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.863 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 14.3 p -67.97 89.8 0.3 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.909 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.657 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 5.8 t -80.97 -126.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.455 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.642 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 81.65 -10.65 1.14 Allowed 'General case' 0 C--N 1.351 0.648 0 CA-C-N 118.86 0.755 . . . . 0.0 109.188 -176.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.3 m -128.25 -61.88 1.07 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.001 177.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.633 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.18 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -178.374 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.439 ' HB3' ' O ' ' A' ' 29' ' ' SER . 9.6 t -179.57 41.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.185 0.902 . . . . 0.0 111.428 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.752 ' CD2' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -83.68 -50.22 8.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.748 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -49.61 -41.35 41.97 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.787 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.637 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -51.33 -56.43 13.11 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.539 0.609 . . . . 0.0 110.981 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.644 ' HG ' ' HG3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -45.9 -52.68 11.08 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.809 0.814 . . . . 0.0 111.56 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 15.3 pttt -79.43 -30.3 42.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.768 -1.105 . . . . 0.0 111.877 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.537 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -66.52 -22.11 66.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.471 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.634 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.13 -41.99 12.65 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.167 178.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.634 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.1 t70 170.81 25.43 0.0 OUTLIER 'General case' 0 C--N 1.359 0.999 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.546 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.4 OUTLIER -170.29 107.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.064 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.64 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 71.6 m-80 -66.8 50.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.732 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.785 HG12 ' HE2' ' A' ' 32' ' ' MET . 1.9 pp 34.89 2.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 119.409 3.115 . . . . 0.0 119.409 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.44 -62.04 0.63 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.294 0.497 . . . . 0.0 110.689 -178.209 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -77.62 -24.7 64.51 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.645 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.508 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 1.8 tm? -67.67 -57.11 6.96 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.999 0.4 . . . . 0.0 110.774 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.646 ' O ' ' HG2' ' B' ' 132' ' ' MET . 88.3 t -50.19 -73.17 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.895 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.736 ' HA ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.43 -33.89 15.2 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 19.8 m -68.81 -47.36 66.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -59.06 -39.61 82.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.516 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.842 ' SD ' HD13 ' A' ' 17' ' ' LEU . 14.7 mmm -57.54 -57.38 12.93 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.532 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -59.34 -38.11 79.54 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.074 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -68.15 -46.74 69.96 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.879 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -71.2 -28.82 64.5 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.601 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.812 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.96 -25.67 43.51 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.304 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.41 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 6.4 mtt-85 -82.54 -53.45 5.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.812 0.815 . . . . 0.0 110.487 178.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -17.49 62.37 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.054 -1.43 . . . . 0.0 114.164 -177.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.598 ' CD2' ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -33.0 -46.02 0.14 Allowed 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -178.24 146.8 0.4 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 66.86 171.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -161.79 112.56 1.65 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.792 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.526 ' HG3' ' SD ' ' A' ' 52' ' ' MET . 0.0 OUTLIER -151.8 179.81 8.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.377 -179.476 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.443 ' O ' ' HA ' ' A' ' 50' ' ' GLU . 1.0 OUTLIER 80.76 50.66 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.769 0.428 . . . . 0.0 112.02 179.656 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -56.5 -46.54 80.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.832 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.4 p -87.92 124.74 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-O 120.888 0.375 . . . . 0.0 111.524 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.83 169.96 13.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.07 177.15 8.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 66.01 81.84 0.2 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.782 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.89 164.15 39.27 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.122 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.25 -64.58 0.57 Allowed Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.206 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.8 79.6 2.73 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.032 0.444 . . . . 0.0 111.45 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.9 m -113.73 142.92 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.996 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.477 ' O ' HG21 ' B' ' 155' ' ' VAL . 0.0 OUTLIER -137.42 -176.88 4.55 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.842 179.51 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.713 ' HA ' ' HB2' ' B' ' 172' ' ' TRP . 24.9 t -159.53 101.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 121.504 0.668 . . . . 0.0 111.104 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -163.43 127.55 2.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.982 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.87 76.06 1.63 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.134 0.493 . . . . 0.0 111.614 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.8 t80 68.56 -60.37 0.43 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 4.9 tp -138.46 -56.24 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.25 172.13 11.47 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.756 0.312 . . . . 0.0 111.224 -179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 54.2 mtm -100.57 155.1 18.05 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -88.5 -44.49 10.66 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.365 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' B' ' 164' ' ' SER . . . 143.28 156.14 6.68 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.714 -0.755 . . . . 0.0 113.097 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' B' ' 163' ' ' GLY . 22.0 t 76.77 141.81 0.07 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.797 0.439 . . . . 0.0 111.665 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.626 ' CE1' ' HB3' ' B' ' 168' ' ' GLU . 0.1 OUTLIER -166.54 117.12 0.95 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.36 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -95.99 -39.29 9.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.206 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.425 ' HB2' ' CE1' ' B' ' 120' ' ' TYR . 2.5 t0 -144.22 60.18 1.35 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.383 0.611 . . . . 0.0 111.447 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.626 ' HB3' ' CE1' ' B' ' 165' ' ' PHE . 5.8 tt0 -175.98 174.02 2.17 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.387 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.72 -73.36 0.06 Allowed 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -139.79 141.45 36.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.871 0.367 . . . . 0.0 111.362 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.95 168.58 26.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.984 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.713 ' HB2' ' HA ' ' B' ' 155' ' ' VAL . 2.0 t90 . . . . . 0 C--O 1.252 1.228 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.72 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.886 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 101.966 -0.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.635 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 100.996 -1.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C1'-C2' 107.284 1.076 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.46 ' H71' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.997 0 C1'-O4'-C4' 106.96 -1.957 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.622 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.772 0 C4'-C3'-C2' 104.8 1.6 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.622 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.411 -0.723 0 C4'-C3'-C2' 104.687 1.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.466 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C1'-C2' 107.084 0.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.463 ' O4 ' ' HD2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O4'--C1' 1.411 -0.715 0 C4'-C3'-C2' 104.305 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 107.017 0.833 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.617 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.9 0 C1'-O4'-C4' 107.405 -1.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.617 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 O4'-C1'-C2' 106.868 0.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.459 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 N19-C1'-C2' 115.141 0.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.048 0.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.885 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C4'-C3' 104.74 -0.86 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C4'-C3'-C2' 102.601 -0.599 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 O4'-C1'-C2' 107.263 1.057 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.559 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.868 0 C4'-C3'-C2' 104.639 1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.62 ' P ' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.036 0 C3'-C2'-C1' 104.837 1.526 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.554 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 105.398 1.927 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.518 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.737 0 C4'-C3'-C2' 105.001 1.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.538 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.754 0 C3'-C2'-C1' 105.363 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.538 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.542 0 C3'-C2'-C1' 104.779 1.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.483 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 C3'-C2'-C1' 105.185 1.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 O4'-C1'-C2' 106.859 0.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.491 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 N19-C1'-C2' 115.616 0.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.467 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C1'-O4'-C4' 110.339 0.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 110.911 -0.033 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.0 ptpt -37.28 128.29 1.0 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.858 0.361 . . . . 0.0 111.617 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.602 ' O ' ' HA ' ' B' ' 108' ' ' THR . 34.5 tp60 -95.9 118.51 32.67 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.211 0.529 . . . . 0.0 110.997 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.732 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.84 105.82 9.28 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.698 0.761 . . . . 0.0 111.584 -178.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.624 HD12 ' CD1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -108.99 111.51 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 177.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -116.49 128.38 55.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.517 -177.424 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.597 HG21 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -98.87 101.51 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 176.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.436 ' CG2' ' NH1' ' B' ' 104' ' ' ARG . 2.3 p -69.72 67.81 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.8 0.81 . . . . 0.0 109.272 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.655 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 9.4 p -79.9 -135.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.384 -178.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.728 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 5.8 t70 91.2 -0.33 0.17 Allowed 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 119.591 1.087 . . . . 0.0 109.165 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.5 -55.98 0.69 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.673 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.732 ' CB ' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -45.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 123.526 0.516 . . . . 0.0 111.579 -179.487 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.534 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 0.3 OUTLIER 176.59 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 119.176 0.898 . . . . 0.0 111.771 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.714 ' CZ ' ' HD3' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -83.39 -43.15 16.21 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -49.83 -39.99 40.68 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.693 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -57.28 -56.6 19.75 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.791 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -54.15 -47.35 72.05 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.021 -0.672 . . . . 0.0 112.268 -177.36 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.714 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 pttt -73.24 -25.76 60.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.301 0.572 . . . . 0.0 110.01 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.439 ' HB1' ' O ' ' A' ' 16' ' ' LEU . . . -64.1 -28.61 69.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.052 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.687 ' CD2' ' HG ' ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.32 -43.12 11.77 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.305 178.685 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.668 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.6 t70 163.84 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.763 ' HB ' HD23 ' A' ' 17' ' ' LEU . 47.6 t -137.89 89.06 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 119.624 1.102 . . . . 0.0 113.588 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.569 ' O ' HD13 ' A' ' 24' ' ' ILE . 46.6 m-80 -68.93 61.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.946 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.724 ' CG1' ' HE3' ' B' ' 132' ' ' MET . 0.4 OUTLIER 45.41 -16.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 117.871 2.545 . . . . 0.0 117.871 -179.362 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.556 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 7.8 t -37.61 -64.49 0.38 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.758 1.163 . . . . 0.0 112.013 -176.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.91 -22.45 57.72 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.684 HD11 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -65.81 -62.05 1.72 Allowed 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 122.728 0.411 . . . . 0.0 110.767 179.644 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.61 ' O ' ' HG2' ' A' ' 32' ' ' MET . 5.2 t -48.79 -63.01 0.4 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.98 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.684 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.813 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -48.44 -36.45 14.94 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.42 HG22 ' CE ' ' A' ' 61' ' ' MET . 25.4 m -69.91 -52.66 22.76 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.6 m -61.23 -39.24 89.55 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.856 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 5.7 mmt -60.06 -57.88 10.94 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.893 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 3.0 tt0 -57.16 -35.22 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -50.41 33.13 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 1.5 tp10 -72.96 -16.34 61.53 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.568 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -86.01 -47.95 9.12 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.815 0.446 . . . . 0.0 110.117 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 1.2 mmt180 -55.58 -52.03 65.12 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.57 0.7 . . . . 0.0 110.77 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -72.85 -50.46 23.82 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.957 -178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.502 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 26.21 55.25 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.4 80.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 128.34 0.24 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.954 0.407 . . . . 0.0 112.084 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.53 157.47 18.07 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.112 0.482 . . . . 0.0 111.293 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -150.16 -61.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.261 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER 67.12 -59.6 0.38 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.337 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -104.09 115.2 29.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.189 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' A' ' 48' ' ' ASN . 2.7 t -114.93 32.54 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.619 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 53.31 -74.99 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' A' ' 46' ' ' VAL . 63.9 t30 60.37 29.17 18.79 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.627 0.251 . . . . 0.0 111.327 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -149.87 164.13 36.19 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.773 0.32 . . . . 0.0 111.403 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 56.0 -114.98 0.88 Allowed 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.333 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.8 164.87 11.31 Favored Glycine 0 C--N 1.339 0.713 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.351 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.601 ' HB2' ' HB3' ' B' ' 144' ' ' TRP . 0.3 OUTLIER -130.49 157.29 43.07 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.872 0.367 . . . . 0.0 111.559 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.477 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 91.3 t -80.51 -59.19 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.231 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.534 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.5 pm0 -72.31 148.64 45.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.683 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.675 ' CB ' ' HB2' ' B' ' 143' ' ' ARG . 15.9 m -130.05 21.74 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.436 ' HB2' ' CD1' ' A' ' 72' ' ' TRP . . . -74.38 64.02 1.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.06 0.457 . . . . 0.0 111.713 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -125.7 22.34 7.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.28 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.58 ' HB3' ' NH2' ' B' ' 143' ' ' ARG . 14.7 p90 -162.62 147.46 12.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.556 0.217 . . . . 0.0 111.447 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 pt -154.61 47.46 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.762 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -153.12 63.03 0.77 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.42 ' CE ' HG22 ' A' ' 30' ' ' THR . 0.1 OUTLIER -179.52 140.93 0.15 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.598 179.099 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -141.27 59.54 1.51 Allowed 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.823 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -157.17 -123.94 0.78 Allowed Glycine 0 C--N 1.334 0.421 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.436 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 65.92 -62.6 0.24 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.83 0.452 . . . . 0.0 111.19 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 44.19 75.84 0.09 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.27 -62.21 1.6 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.129 0.49 . . . . 0.0 111.661 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -171.3 -71.15 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.095 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -89.52 120.23 30.65 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.766 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.91 111.75 5.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.527 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -152.95 110.02 3.49 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.592 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.69 -174.15 2.63 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.924 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.534 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 6.2 t-105 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.623 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.425 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 1.8 ttp . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.4 102.9 8.77 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.728 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 36.4 tt0 -101.97 114.6 28.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.243 0.544 . . . . 0.0 109.975 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.511 ' HD2' ' N7 ' ' D' ' 192' ' ' ' DA' . 11.9 ttm-85 -79.32 99.93 7.34 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.282 -177.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.626 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -108.1 110.31 31.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.791 ' OG1' ' H71' ' D' ' 191' ' ' ' DT' . 0.3 OUTLIER -107.15 122.19 46.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.863 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.576 ' HA ' " O5'" ' D' ' 190' ' ' ' DG' . 0.4 OUTLIER -101.08 95.11 3.76 Favored 'Isoleucine or valine' 0 C--N 1.343 0.285 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.732 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 74.3 p -68.16 94.03 0.48 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.248 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.693 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -80.9 -132.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.925 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 19.9 t70 91.23 -12.53 0.24 Allowed 'General case' 0 C--N 1.351 0.637 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -129.66 -54.27 1.15 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.445 178.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.813 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.7 OUTLIER -48.72 -99.63 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -179.2 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.229 -0.92 . . . . 0.0 110.828 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.693 ' HB3' ' CG2' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.27 -39.14 21.23 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.944 1.091 . . . . 0.0 113.944 -179.062 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.487 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.3 -39.63 22.43 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -175.183 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.568 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -60.89 -56.68 18.27 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.856 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 1.5 mt -57.46 -38.19 74.09 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.318 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.631 ' HD3' ' OH ' ' B' ' 114' ' ' TYR . 0.8 OUTLIER -79.35 -31.23 42.96 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.155 0.503 . . . . 0.0 111.132 178.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.603 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.67 -28.92 67.69 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.364 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.713 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.28 -42.62 12.13 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 117.469 -1.253 . . . . 0.0 110.977 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.713 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 2.7 p30 151.35 12.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.572 HG13 ' N ' ' B' ' 123' ' ' ASN . 1.4 p -89.83 -31.17 5.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 118.882 0.764 . . . . 0.0 112.886 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.572 ' N ' HG13 ' B' ' 122' ' ' VAL . 1.8 m-80 36.04 41.12 0.12 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.028 0.531 . . . . 0.0 111.621 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.777 ' CG2' ' HE3' ' A' ' 32' ' ' MET . 0.5 OUTLIER 43.74 -8.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 N-CA-C 118.494 2.775 . . . . 0.0 118.494 179.438 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.597 ' HA ' HG21 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.87 -63.29 0.54 Allowed 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.114 1.324 . . . . 0.0 110.026 -177.842 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.43 -23.19 54.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.024 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.617 ' HG ' HD12 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.72 -61.05 2.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.521 0.328 . . . . 0.0 111.209 179.892 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.652 ' O ' ' HG2' ' B' ' 132' ' ' MET . 17.2 t -50.13 -63.69 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.459 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.732 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 13.5 p -49.9 -43.83 49.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 23.5 m -68.87 -53.68 19.88 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.502 HG22 ' HA ' ' B' ' 128' ' ' VAL . 2.1 t -56.14 -40.23 73.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.688 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.791 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -62.09 -57.75 10.4 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.282 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.534 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 1.3 tp60 -49.65 -40.9 41.22 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.038 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.586 ' HB3' ' HG2' ' B' ' 142' ' ' GLU . 81.4 m-20 -69.56 -57.12 5.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.072 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.583 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 0.3 OUTLIER -66.81 -14.73 62.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.333 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.693 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.14 -52.79 5.05 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.198 0.599 . . . . 0.0 111.689 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -54.96 -56.32 20.93 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.379 0.609 . . . . 0.0 111.825 -178.711 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.556 ' HB2' ' HB2' ' B' ' 142' ' ' GLU . 0.1 OUTLIER -83.15 -24.78 32.38 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.095 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.687 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 40.44 47.22 2.21 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-O 121.506 0.67 . . . . 0.0 111.116 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -168.14 -58.73 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.044 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.48 -44.39 0.22 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.586 ' HG2' ' HB3' ' B' ' 134' ' ' ASN . 3.8 tp10 54.12 82.36 0.09 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.675 ' HB2' ' CB ' ' A' ' 55' ' ' VAL . 23.8 mmt180 -149.59 122.93 9.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.785 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.601 ' HB3' ' HB2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -129.11 -162.21 1.18 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.712 0.291 . . . . 0.0 110.997 -179.181 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -67.71 -45.25 75.64 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER 52.4 66.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 121.344 0.592 . . . . 0.0 110.931 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -87.9 171.33 10.43 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.44 116.07 25.3 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.534 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.64 155.12 4.74 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.136 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -135.63 157.68 46.28 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.124 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -104.99 -177.2 24.53 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.856 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.3 tpp -139.73 51.42 1.73 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.86 0.362 . . . . 0.0 111.509 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.8 p -179.14 123.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -115.05 148.08 39.34 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 111.845 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 1.5 m -155.69 61.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.697 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -106.13 -43.67 4.77 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -152.44 173.35 15.22 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.495 0.188 . . . . 0.0 111.379 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -54.37 -39.63 67.35 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.781 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.7 mp -105.64 115.47 47.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-O 120.888 0.375 . . . . 0.0 110.873 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -66.67 156.63 34.71 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.398 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 4.3 ttt 68.65 88.21 0.11 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.643 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -54.99 -34.77 63.69 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.687 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 126.74 -70.95 0.49 Allowed Glycine 0 C--N 1.337 0.621 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.422 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t 79.05 -174.7 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.225 0.536 . . . . 0.0 111.972 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.75 -153.06 0.3 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.081 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -52.44 -74.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.043 0.449 . . . . 0.0 110.677 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.11 63.91 0.61 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.866 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.69 165.69 17.47 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.172 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -144.22 150.66 38.32 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.973 0.416 . . . . 0.0 111.752 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' B' ' 170' ' ' LYS . 0.0 OUTLIER -128.41 121.28 28.68 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.842 179.402 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -60.58 145.41 48.9 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.275 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 80.2 m95 . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.938 -179.708 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.883 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-C2' 106.848 0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.469 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C1'-O4'-C4' 110.295 0.425 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.46 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 104.641 1.386 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.949 0 C4'-C3'-C2' 104.627 1.427 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.505 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C4'-C3'-C2' 104.704 1.504 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.511 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.664 0 C4'-C3'-C2' 104.555 1.355 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.511 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 104.899 1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.708 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 N19-C1'-C2' 115.72 0.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.708 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 O4'-C1'-C2' 107.229 1.026 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.594 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.771 0 C3'-C2'-C1' 105.61 2.079 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.594 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 N19-C1'-C2' 112.548 -1.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.466 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.597 -0.788 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 106.981 0.801 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.873 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 C1'-O4'-C4' 110.506 0.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 O4'-C1'-C2' 107.126 0.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.504 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 101.571 -0.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.802 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C4'-C3'-C2' 101.833 -1.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.802 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.857 0 C4'-C3'-C2' 104.32 1.12 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.791 ' H71' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.507 -0.977 0 C3'-C2'-C1' 101.416 -0.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.522 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 C3'-C2'-C1' 105.417 1.941 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.522 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.699 0 C4'-C3'-C2' 104.575 1.375 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.41 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C1'-O4'-C4' 110.597 0.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.443 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.979 0 C1'-O4'-C4' 106.841 -2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.463 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.526 0 C1'-O4'-C4' 110.909 0.864 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.426 ' C5 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 O4'-C1'-C2' 104.864 -1.124 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C1'-O4'-C4' 110.435 0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.475 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 66.2 mtm . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 1' ' ' MET . 2.0 mptp? 72.49 109.58 0.07 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.991 0.424 . . . . 0.0 110.451 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' B' ' 108' ' ' THR . 29.3 tp60 -104.2 107.38 18.26 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.219 0.533 . . . . 0.0 110.235 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.753 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.6 ttm180 -78.19 102.87 7.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.72 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.692 ' CD1' HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -108.1 127.19 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 177.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.632 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -129.73 127.77 41.11 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.81 -0.756 . . . . 0.0 112.529 -176.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.51 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -100.57 109.06 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.363 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.404 ' HB ' ' HB2' ' B' ' 102' ' ' LYS . 5.8 p -70.56 94.31 0.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.083 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.692 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 2.8 t -84.6 -132.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.827 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.658 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 3.8 t70 82.63 -10.32 1.07 Allowed 'General case' 0 C--N 1.35 0.627 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.1 m -128.4 -58.18 1.19 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.204 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.812 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 1.3 m-20 -49.7 -101.96 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -177.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 36.02 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.558 -0.714 . . . . 0.0 110.701 -178.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.692 ' HB3' ' CG1' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.01 -39.15 23.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.303 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.633 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.12 -45.52 33.12 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -176.846 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.698 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -54.59 -47.32 73.49 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.943 0.792 . . . . 0.0 111.893 -179.615 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.827 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.82 -49.86 76.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.117 -179.461 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.633 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.5 OUTLIER -73.99 -26.06 60.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.299 178.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -65.38 -27.53 68.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.409 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.665 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.1 -42.19 12.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.468 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.665 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.6 21.34 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 176.287 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.605 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 61.7 t -156.71 94.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.597 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.504 ' HB2' HD13 ' A' ' 24' ' ' ILE . 3.3 p30 -60.34 -93.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.775 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -148.61 3.08 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 179.072 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.629 ' HB2' ' OP1' ' D' ' 190' ' ' ' DG' . 4.1 t -38.03 -63.17 0.5 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.662 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.05 -29.99 18.63 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.507 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.697 ' CD2' ' SD ' ' B' ' 132' ' ' MET . 13.0 tp -56.52 -61.97 2.05 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 117.282 0.541 . . . . 0.0 110.718 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.775 HG23 ' HB ' ' A' ' 24' ' ' ILE . 4.1 t -54.66 -57.09 7.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-O 121.774 0.797 . . . . 0.0 109.097 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.839 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 60.2 m -47.38 -49.84 23.71 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.802 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.5 OUTLIER -80.75 -47.4 13.99 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.78 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.34 -43.83 92.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.69 -179.321 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.783 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 5.6 mmt -54.01 -57.11 12.26 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.319 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.553 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -54.86 -36.97 65.66 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -52.88 22.03 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.55 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 1.6 tp10 -70.78 -25.31 62.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.408 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.734 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -81.88 -25.22 35.21 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 122.839 0.456 . . . . 0.0 110.747 178.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -79.66 -46.99 16.14 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 122.095 0.95 . . . . 0.0 108.835 178.05 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.47 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -76.89 -46.36 24.73 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 113.233 -1.803 . . . . 0.0 113.172 -177.712 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.489 HD22 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 8.59 65.07 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.514 0.726 . . . . 0.0 112.935 -177.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 175.88 62.87 0.0 OUTLIER 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.322 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 179.23 159.79 0.68 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.613 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -69.37 51.34 0.1 Allowed 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 73.28 134.75 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.3 67.48 1.9 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.046 0.451 . . . . 0.0 109.991 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -87.02 151.82 22.93 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 30.5 m -121.09 122.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.139 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.15 -160.47 1.01 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.876 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 82.94 120.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.235 0.54 . . . . 0.0 111.742 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pm0 -171.52 125.48 0.61 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.296 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.89 -75.15 0.52 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -178.64 73.79 0.07 OUTLIER Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.938 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.32 163.72 32.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.701 0.286 . . . . 0.0 110.62 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 85.2 t -99.31 -65.09 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.228 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -86.6 149.94 24.57 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.901 0.381 . . . . 0.0 111.486 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.476 ' HB ' ' CE2' ' A' ' 72' ' ' TRP . 67.9 t -124.38 4.24 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.97 136.58 56.15 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.97 0.414 . . . . 0.0 111.611 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.2 mtt-85 -148.33 -65.67 0.24 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.409 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.452 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -154.5 -155.34 0.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.787 -179.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 58' ' ' PHE . 2.7 mp 77.38 100.98 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.941 0.4 . . . . 0.0 111.132 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.16 -42.71 83.86 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.347 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.4 mmt -61.58 121.77 13.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -45.19 130.18 7.9 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.77 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -72.14 92.74 0.57 Allowed Glycine 0 C--N 1.331 0.299 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.918 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.7 t 67.54 -150.92 0.18 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.489 0.185 . . . . 0.0 111.208 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.3 87.43 1.81 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.823 0.344 . . . . 0.0 111.692 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -139.76 -126.25 0.11 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.721 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -126.52 71.47 1.29 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 111.246 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -94.98 48.67 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.653 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -65.05 -74.58 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.8 58.47 0.14 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 62.32 -70.76 0.05 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.585 ' CE3' ' HD2' ' B' ' 140' ' ' ARG . 1.1 t90 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.95 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 N-CA-C 111.348 0.129 . . . . 0.0 111.348 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 22.7 mmmt -104.05 -176.59 3.12 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.046 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.63 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -104.88 107.68 18.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.119 0.485 . . . . 0.0 111.014 179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.577 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.2 OUTLIER -78.59 106.97 10.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.856 0.836 . . . . 0.0 111.875 -178.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.653 HG21 ' CG ' ' A' ' 14' ' ' TYR . 1.4 pt -110.04 120.77 61.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.089 178.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.632 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.01 125.8 32.38 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -177.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.692 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.47 103.84 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.753 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 82.1 p -68.94 90.15 0.43 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.192 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.686 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 2.2 t -79.22 -134.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.296 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.609 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 35.3 t70 90.54 -5.74 0.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.711 0.767 . . . . 0.0 109.192 -176.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -134.61 -59.37 0.81 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.156 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.839 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 1.5 m-20 -47.98 -95.03 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.553 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 1.2 m -177.93 35.0 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.362 -0.836 . . . . 0.0 111.404 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.686 ' HB3' ' CG2' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -80.6 -43.97 19.7 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.645 0.778 . . . . 0.0 111.269 179.302 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 81.8 mt-30 -49.81 -38.29 34.01 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.68 -177.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.734 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -57.27 -56.52 20.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.528 0.603 . . . . 0.0 112.211 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.783 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -54.6 -40.07 68.51 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.733 -178.29 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.24 -32.3 43.79 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.458 0.647 . . . . 0.0 110.938 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.571 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -62.98 -28.88 70.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.611 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.651 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.3 OUTLIER -88.02 -46.28 9.47 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.661 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.651 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 3.2 t0 165.87 12.72 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 72.7 t -153.69 91.99 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-N 118.783 0.719 . . . . 0.0 112.014 -177.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.636 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.0 OUTLIER -59.3 -102.36 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.707 HG22 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.37 4.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 179.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.45 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -44.41 -64.03 0.77 Allowed 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.327 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.463 ' HA2' ' OG ' ' B' ' 129' ' ' SER . . . -86.1 -29.74 24.72 Favored Glycine 0 C--N 1.337 0.631 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.071 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.656 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.4 -61.38 2.37 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 122.342 0.257 . . . . 0.0 110.649 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.685 HG21 ' HB ' ' B' ' 124' ' ' ILE . 2.4 t -54.64 -61.88 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-O 121.347 0.594 . . . . 0.0 110.103 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.812 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 9.0 p -47.99 -44.05 30.32 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -78.65 -47.79 16.34 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.447 0.567 . . . . 0.0 109.972 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.443 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 3.2 m -60.13 -47.69 84.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.322 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.827 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 4.5 mmt -54.64 -53.63 52.28 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.484 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -49.39 -40.11 34.86 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -69.75 -48.99 57.37 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 121.367 -0.133 . . . . 0.0 110.911 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -74.66 -13.57 60.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.914 0.388 . . . . 0.0 110.214 178.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.698 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.75 -48.52 7.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -51.6 -54.53 26.69 Favored 'General case' 0 CA--C 1.5 -0.97 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.266 178.701 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -82.01 -50.1 9.5 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.505 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.643 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 47.24 76.07 0.11 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 179.12 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.585 ' HD2' ' CE3' ' A' ' 72' ' ' TRP . 0.2 OUTLIER 168.36 159.34 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 178.382 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -82.77 126.58 32.57 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.844 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' B' ' 143' ' ' ARG . 18.5 tt0 -163.45 160.08 22.94 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.683 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.462 ' C ' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 8.66 89.6 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 179.535 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.45 ' C ' ' HG3' ' B' ' 145' ' ' LYS . 9.7 p-90 -74.7 39.36 0.13 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.45 ' HG3' ' C ' ' B' ' 144' ' ' TRP . 0.0 OUTLIER 163.1 152.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.687 0.795 . . . . 0.0 110.081 179.355 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 33.2 m -101.74 162.13 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -140.15 34.21 1.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.051 0.453 . . . . 0.0 111.378 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -137.03 -166.35 1.9 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.664 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -76.46 -87.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.534 0.207 . . . . 0.0 111.51 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -163.4 -56.9 0.04 OUTLIER 'General case' 0 C--O 1.239 0.527 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.241 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 138.81 -162.39 25.88 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.742 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -147.18 68.06 1.15 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.184 0.516 . . . . 0.0 111.135 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 2.2 p -171.58 170.09 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.001 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.97 149.55 50.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.923 0.392 . . . . 0.0 110.807 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.474 ' CG2' ' CZ2' ' B' ' 172' ' ' TRP . 3.3 m -147.65 40.82 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 121.37 0.605 . . . . 0.0 111.326 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.4 -159.13 0.18 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.078 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.94 156.39 22.33 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.779 0.323 . . . . 0.0 111.092 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.434 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 44.8 m-85 -91.68 -160.4 0.73 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.992 179.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.434 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 44.1 mt 74.33 -64.94 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.98 77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.295 0.569 . . . . 0.0 111.875 -179.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.6 ptm -161.37 76.49 0.53 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.901 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -135.01 -66.66 0.57 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.363 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -77.74 -0.14 73.23 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.692 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 5.3 t 79.3 179.57 0.11 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.911 0.355 . . . . 0.0 111.213 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.641 ' CG ' ' HB3' ' B' ' 168' ' ' GLU . 0.3 OUTLIER -172.24 114.73 0.32 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.404 -179.567 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -67.66 -28.41 67.68 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -95.83 -52.53 4.04 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.641 ' HB3' ' CG ' ' B' ' 165' ' ' PHE . 12.1 tp10 -48.63 104.38 0.06 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.094 0.473 . . . . 0.0 111.308 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -71.32 -22.92 61.86 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? 70.22 -59.36 0.52 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.544 0.211 . . . . 0.0 111.394 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.44 ' O ' ' CB ' ' B' ' 172' ' ' TRP . 1.1 m-20 -64.47 -18.2 64.55 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.607 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.474 ' CZ2' ' CG2' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.256 0 C-N-CA 123.608 0.763 . . . . 0.0 109.998 -179.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.885 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C3'-C2'-C1' 101.764 -0.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.545 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 N19-C1'-C2' 115.266 0.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.545 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 O4'-C1'-C2' 107.381 1.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.417 ' C7 ' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.925 0 C4'-C3'-C2' 104.634 1.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.556 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.022 0 C3'-C2'-C1' 104.87 1.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.556 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.699 0 O4'-C1'-C2' 104.923 -1.07 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.624 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 106.198 2.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.661 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 N19-C1'-C2' 114.948 0.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.661 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 104.489 1.278 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.647 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.765 0 C3'-C2'-C1' 105.548 2.034 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.647 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-C2' 106.917 0.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.574 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.146 0.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . 0.44 ' C2 ' ' C6 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C5'-C4'-O4' 108.767 -0.396 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.886 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 C3'-C2'-C1' 101.946 -0.538 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.629 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.549 0 O4'-C1'-C2' 106.866 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.629 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.538 0 C4'-C3'-C2' 103.977 0.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.441 H2'' ' OP2' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C4'-C3'-C2' 102.34 -0.86 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.629 ' OP1' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C3'-C2'-C1' 105.896 2.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.53 " H2'" ' C8 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C4'-C3' 104.492 -1.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.53 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.788 0 C1'-O4'-C4' 110.807 0.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.577 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.41 -0.794 0 C3'-C2'-C1' 104.971 1.622 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.475 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 O4'-C1'-C2' 107.127 0.934 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.475 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.939 0 C1'-O4'-C4' 107.581 -1.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.292 1.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.536 0.798 0 O4'-C1'-C2' 105.151 -0.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C1'-O4'-C4' 110.26 0.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 ttp . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 -174.04 4.77 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.581 0.229 . . . . 0.0 110.982 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.589 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 4.2 tt0 -124.23 121.8 36.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.584 0.707 . . . . 0.0 111.771 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.898 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.7 ttp-105 -79.81 113.25 17.82 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.069 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.771 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -103.4 124.35 57.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.65 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.591 ' CG2' ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -129.99 123.61 31.01 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.434 -0.906 . . . . 0.0 111.844 -177.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.662 HG23 HD12 ' B' ' 124' ' ' ILE . 1.2 t -100.67 108.46 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.417 HG22 ' HG3' ' B' ' 104' ' ' ARG . 10.9 p -70.9 89.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.753 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 2.1 t -86.41 -132.31 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 119.106 -0.473 . . . . 0.0 111.985 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.669 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.9 t70 82.4 -8.82 1.21 Allowed 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -175.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -130.1 -63.23 0.91 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.119 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.684 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.72 -89.84 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.772 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.9 t 176.53 39.55 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.705 0.764 . . . . 0.0 110.772 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.872 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -83.71 -44.25 14.67 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.877 -179.251 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -47.53 -37.9 13.04 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -175.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.629 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.83 -56.6 19.27 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.721 0.692 . . . . 0.0 112.458 -179.628 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.895 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.65 -43.87 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.457 0.646 . . . . 0.0 111.378 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.706 ' HB3' ' HB3' ' A' ' 23' ' ' ASN . 4.2 pttt -79.65 -30.95 41.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.605 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.486 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -59.34 -29.05 67.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.873 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.65 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.12 -46.55 9.2 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.463 178.459 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.65 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 154.83 19.72 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 176.125 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.504 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 75.0 t -156.58 84.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 118.165 0.438 . . . . 0.0 111.678 -178.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.706 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -58.08 -96.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.67 HG23 ' HE3' ' B' ' 132' ' ' MET . 0.3 OUTLIER -138.98 -3.71 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 115.664 1.728 . . . . 0.0 115.664 -179.427 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.526 ' HB3' ' OP2' ' D' ' 190' ' ' ' DG' . 78.3 p -39.05 -64.23 0.47 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-N 119.057 0.844 . . . . 0.0 109.501 -179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.414 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -85.22 -29.99 26.46 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.65 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.561 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 4.9 tp -58.64 -61.98 2.2 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.875 0.338 . . . . 0.0 110.83 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.609 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.1 t -52.03 -67.25 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.658 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 90.9 p -48.45 -36.76 15.64 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -78.47 -45.93 20.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.556 0.616 . . . . 0.0 109.595 178.427 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.412 ' N ' ' CG2' ' A' ' 30' ' ' THR . 20.9 m -64.0 -50.02 70.18 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.65 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.752 ' HE3' ' CG2' ' B' ' 124' ' ' ILE . 2.6 mmt -50.96 -43.13 60.33 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.849 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.434 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -61.21 -48.92 79.27 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -47.47 85.4 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.566 ' CB ' HD23 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -64.75 -38.63 91.64 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.57 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 39' ' ' LEU . . . -59.11 -47.27 85.87 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -51.91 67.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 39' ' ' LEU . 6.2 mmt180 -52.97 -49.93 65.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.925 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.507 ' CD1' ' HB3' ' B' ' 120' ' ' TYR . 0.4 OUTLIER -16.86 108.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.328 1.051 . . . . 0.0 113.2 179.681 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -141.35 -55.93 0.48 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.88 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.47 153.5 17.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.36 178.79 6.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.922 0.392 . . . . 0.0 111.808 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.674 ' NH1' ' HA ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -164.74 -80.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.405 178.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.474 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 161.03 -59.86 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.392 0.677 . . . . 0.0 110.362 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.525 ' HA ' ' O ' ' B' ' 170' ' ' LYS . 0.0 OUTLIER 72.14 119.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.596 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.465 HG11 ' O ' ' A' ' 46' ' ' VAL . 14.6 p -51.87 129.02 11.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 111.542 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -78.93 115.49 18.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.541 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -169.94 145.18 2.88 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.968 0.413 . . . . 0.0 111.506 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.56 103.7 12.87 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.197 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.63 155.14 25.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.907 0.384 . . . . 0.0 111.625 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 174.16 126.9 0.95 Allowed Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.488 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.8 mtt -106.06 145.99 30.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.793 0.33 . . . . 0.0 111.304 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.9 t -83.4 158.24 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.608 -179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.625 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.7 pt-20 36.94 55.18 1.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.444 0.64 . . . . 0.0 112.478 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.499 ' CG2' ' HB3' ' A' ' 72' ' ' TRP . 8.0 m -89.29 74.93 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.177 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.425 ' O ' ' N ' ' A' ' 58' ' ' PHE . . . -110.5 -85.28 0.55 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.959 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 56.87 -79.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.711 0.405 . . . . 0.0 111.818 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -143.92 75.4 1.47 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.108 0.48 . . . . 0.0 110.32 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.435 HD13 HG23 ' A' ' 59' ' ' ILE . 9.7 tt -112.12 84.12 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.251 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.5 143.94 44.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.232 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.421 ' HG3' ' HD2' ' B' ' 140' ' ' ARG . 5.9 mmt -159.11 75.78 0.69 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -67.99 64.64 0.09 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.342 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 162.53 95.75 0.11 Allowed Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.94 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.4 p -84.48 158.94 20.85 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.836 0.35 . . . . 0.0 111.346 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -105.78 -41.04 5.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.232 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -130.73 -71.83 0.57 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.038 0.447 . . . . 0.0 110.636 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -112.09 -160.47 0.72 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.93 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.46 -156.9 0.6 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.272 0.229 . . . . 0.0 110.582 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.441 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -156.86 119.6 4.02 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.122 0.487 . . . . 0.0 111.953 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.441 ' NZ ' ' O ' ' A' ' 69' ' ' ASN . 20.8 mmtm -136.08 151.88 50.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.619 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 64.86 179.64 0.18 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.411 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.625 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.739 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 111.356 0.132 . . . . 0.0 111.356 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 5.3 mmpt? -73.83 -179.49 3.7 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.094 0.246 . . . . 0.0 110.954 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 9' ' ' VAL . 26.9 tp60 -114.01 115.25 27.32 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.942 0.401 . . . . 0.0 111.887 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.426 ' HG3' ' NH1' ' B' ' 104' ' ' ARG . 5.9 ttm-85 -78.42 109.18 12.35 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.876 0.846 . . . . 0.0 111.773 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.652 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.8 OUTLIER -108.16 127.31 64.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 113.993 -1.458 . . . . 0.0 107.115 177.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.591 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.46 129.86 41.73 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -177.301 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.559 ' O ' HG21 ' A' ' 5' ' ' ILE . 1.1 m -101.57 99.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 173.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.898 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -70.76 67.48 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.793 -0.763 . . . . 0.0 111.782 -177.695 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.632 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 3.8 m -99.67 -114.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.589 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 10.0 t0 145.74 -84.82 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -88.19 2.84 51.3 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.134 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.658 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -76.14 62.26 1.68 Allowed 'General case' 0 C--N 1.357 0.93 0 CA-C-N 119.588 1.085 . . . . 0.0 108.73 179.419 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.622 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 59.55 -25.58 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.755 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.771 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -44.49 -62.19 1.27 Allowed 'General case' 0 C--N 1.348 0.534 0 C-N-CA 123.352 0.661 . . . . 0.0 111.411 -179.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.576 ' N ' ' CG ' ' B' ' 114' ' ' TYR . 2.6 pp0? -49.45 -33.59 14.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.58 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.447 ' HA ' ' HB3' ' B' ' 119' ' ' ALA . 0.2 OUTLIER -60.4 -50.18 74.61 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.709 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -52.53 -51.97 57.05 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.695 0.759 . . . . 0.0 111.557 -179.571 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.637 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -73.47 -29.02 62.26 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.193 179.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.447 ' HB3' ' HA ' ' B' ' 116' ' ' LEU . . . -64.54 -25.72 68.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.607 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.3 OUTLIER -87.78 -41.0 13.59 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 118.608 -0.711 . . . . 0.0 109.804 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 158.68 39.04 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 177.057 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.61 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.1 94.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.637 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 59.1 m-80 -67.3 71.01 0.11 Allowed 'General case' 0 N--CA 1.462 0.128 0 O-C-N 121.599 -0.688 . . . . 0.0 109.584 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.752 ' CG2' ' HE3' ' A' ' 32' ' ' MET . 0.3 OUTLIER 37.59 -10.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.598 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.1 OUTLIER -37.84 -55.99 1.14 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 120.002 1.274 . . . . 0.0 110.52 -176.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.533 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.16 -30.42 28.31 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.311 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.609 HD11 ' SD ' ' A' ' 32' ' ' MET . 1.7 tm? -60.88 -61.26 2.71 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.952 0.376 . . . . 0.0 110.687 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.587 HG21 ' HB ' ' B' ' 124' ' ' ILE . 41.4 t -50.68 -64.19 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.684 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 24.7 p -50.42 -48.7 56.08 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.533 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -62.92 -50.92 68.94 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 23.4 m -58.01 -42.69 85.78 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.06 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.895 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -59.19 -57.26 13.82 Favored 'General case' 0 C--O 1.209 -1.071 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.403 179.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.9 OUTLIER -49.1 -41.67 36.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.606 179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -51.91 54.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.602 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.647 ' HB3' HD21 ' A' ' 17' ' ' LEU . 8.9 tp10 -74.73 -14.57 60.74 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.684 0.278 . . . . 0.0 110.613 178.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.629 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.63 -38.02 16.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 123.211 0.604 . . . . 0.0 110.994 179.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -71.84 -53.45 13.24 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.835 0.826 . . . . 0.0 110.312 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -84.67 -41.63 16.11 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 113.969 -1.469 . . . . 0.0 113.62 -177.958 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.572 HD21 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 40.8 32.78 0.17 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.783 0.433 . . . . 0.0 111.356 -177.192 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.485 ' HG2' ' N ' ' B' ' 141' ' ' ALA . 15.9 ttp85 -179.74 151.98 0.47 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.322 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.485 ' N ' ' HG2' ' B' ' 140' ' ' ARG . . . -58.39 129.11 40.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.384 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.02 175.62 10.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.402 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -166.03 -64.09 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.41 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.427 ' HE3' ' HA ' ' B' ' 144' ' ' TRP . 0.0 OUTLIER 62.54 -81.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 179.444 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.04 -45.4 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.81 90.34 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-O 121.344 0.592 . . . . 0.0 110.961 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -105.69 99.53 9.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.433 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.3 78.64 1.14 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.01 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -179.61 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.548 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -117.53 -140.74 0.36 Allowed 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.93 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.04 -78.29 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.567 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.8 mmt 70.56 99.12 0.06 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 122.756 0.422 . . . . 0.0 111.709 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 4.6 m -120.6 -59.13 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.714 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.44 -61.45 1.6 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.67 0.272 . . . . 0.0 110.795 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.736 ' HA ' ' CB ' ' B' ' 172' ' ' TRP . 10.3 m 41.51 36.54 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.7 119.5 24.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.255 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -145.67 -78.95 0.18 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.563 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -127.43 -56.2 1.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 45.5 mm -111.68 133.19 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.886 0.374 . . . . 0.0 111.037 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.84 70.6 9.55 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.508 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.5 mmt -138.9 115.57 10.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.441 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -74.8 58.59 0.83 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.998 0.427 . . . . 0.0 111.768 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -156.87 69.55 0.28 Allowed Glycine 0 C--N 1.332 0.358 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.387 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.1 p -162.8 78.7 0.47 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.619 0.247 . . . . 0.0 111.122 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -157.18 78.2 0.88 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.468 ' HA ' ' HA ' ' A' ' 39' ' ' LEU . . . -95.09 -108.15 0.14 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -65.71 -48.35 72.27 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.282 0.563 . . . . 0.0 109.498 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -117.65 128.78 55.25 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.661 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -71.4 -87.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.058 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -170.87 -101.12 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.485 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -157.43 -55.94 0.08 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.635 0.255 . . . . 0.0 110.511 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.736 ' CB ' ' HA ' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.921 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.875 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-C2' 107.146 0.951 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.912 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.545 0 C4'-C3'-C2' 101.671 -1.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.912 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 C3'-C2'-C1' 105.494 1.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.543 ' C6 ' " C2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.76 0 C4'-C3'-C2' 104.526 1.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.598 ' OP1' ' HB2' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.001 0 C3'-C2'-C1' 105.27 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.59 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C4'-C3'-C2' 104.255 1.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.574 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.761 0 C3'-C2'-C1' 106.416 2.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.574 " O5'" H2'' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C3'-C2'-C1' 102.128 -0.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.425 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C1'-C2' 107.154 0.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.572 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.854 0 C3'-C2'-C1' 105.056 1.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.572 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-C2' 107.174 0.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.569 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.173 0.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . 0.456 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C1'-O4'-C4' 110.42 0.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.89 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 107.268 1.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.553 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.111 0.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.801 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 C1'-O4'-C4' 110.547 0.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.844 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 P--O5' 1.597 0.373 0 C1'-O4'-C4' 110.833 0.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.526 ' OP2' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.002 0 C4'-C3'-C2' 104.74 1.54 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.574 ' H71' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 105.239 1.814 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.472 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.695 0 C3'-C2'-C1' 105.846 2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.472 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C4'-C3'-C2' 104.603 1.403 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.47 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C1'-O4'-C4' 110.706 0.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.47 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.048 0 C1'-O4'-C4' 107.748 -1.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.455 ' C8 ' H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 O4'-C1'-C2' 106.991 0.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.439 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.792 0 C4'-C3'-C2' 104.186 0.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C1'-O4'-C4' 110.285 0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.532 0.206 . . . . 0.0 111.539 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.568 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 20.7 mmtm -148.15 143.02 26.81 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.746 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.62 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -112.85 114.54 27.11 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 120.927 0.394 . . . . 0.0 111.449 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.902 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.49 104.67 10.26 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.156 -0.618 . . . . 0.0 110.824 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.668 ' CD1' ' CD1' ' B' ' 114' ' ' TYR . 1.4 pt -109.41 127.92 65.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.842 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.9 141.74 48.54 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 117.955 -1.498 . . . . 0.0 113.316 -178.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.71 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.41 102.39 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.525 -1.216 . . . . 0.0 109.16 177.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.655 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -70.18 76.92 0.52 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.707 HG12 ' CB ' ' A' ' 14' ' ' TYR . 9.2 p -110.67 -128.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.907 -176.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.767 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 5.3 t70 94.76 23.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 122.841 1.305 . . . . 0.0 109.399 -175.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -150.24 -50.47 0.13 Allowed 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 112.746 -2.025 . . . . 0.0 110.486 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.703 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 5.6 m-20 -79.16 46.3 0.7 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.485 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 68.9 m 66.82 9.77 7.03 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.781 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -60.75 -50.74 72.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.969 1.258 . . . . 0.0 111.001 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.664 ' HA ' ' HE3' ' A' ' 18' ' ' LYS . 14.3 mm-40 -48.95 -32.46 9.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -56.49 13.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.755 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.29 -56.08 8.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.275 0.559 . . . . 0.0 112.187 -178.306 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.664 ' HE3' ' HA ' ' A' ' 15' ' ' GLN . 5.1 pttp -69.21 -25.98 64.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.491 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.507 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -69.13 -26.74 65.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.07 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.538 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -87.54 -38.57 15.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.725 -0.655 . . . . 0.0 109.664 178.812 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 156.69 25.04 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 177.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.517 ' O ' ' N ' ' A' ' 24' ' ' ILE . 54.4 t -147.89 82.87 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.594 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 3.0 m-20 -64.65 63.79 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.939 0.4 . . . . 0.0 110.593 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.803 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 0.4 OUTLIER 40.96 -13.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 23' ' ' ASN . 10.1 t -38.25 -61.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 119.862 1.21 . . . . 0.0 110.337 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.427 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -78.89 -36.13 29.38 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.031 178.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.522 HD21 ' HG ' ' A' ' 17' ' ' LEU . 7.9 tp -56.58 -61.87 2.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.766 0.317 . . . . 0.0 110.183 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.755 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.7 t -50.21 -64.52 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.176 178.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.676 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 26.5 p -49.36 -45.34 45.69 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -70.06 -42.94 72.17 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.567 ' OG1' HG21 ' B' ' 131' ' ' THR . 35.2 m -61.49 -42.78 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.038 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.81 ' CE ' HG12 ' B' ' 124' ' ' ILE . 1.4 mmt -50.27 -50.67 49.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.502 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.42 -45.15 95.52 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.145 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.74 -52.59 59.79 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.722 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.617 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 0.0 OUTLIER -61.61 -37.1 82.7 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.154 178.714 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.45 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -66.23 -38.94 89.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.704 178.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -73.2 -56.1 5.56 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.397 0.618 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.29 -36.6 39.43 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.183 -177.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.742 HD11 ' CE2' ' B' ' 120' ' ' TYR . 61.1 mt 33.02 -104.31 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.202 0.601 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 35.3 ttt85 60.2 21.78 11.12 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' B' ' 169' ' ' ASN . . . 72.58 162.12 0.25 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.332 0.587 . . . . 0.0 112.308 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -92.23 172.12 8.63 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.51 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.719 ' HB2' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -119.66 136.96 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.922 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.46 156.06 33.36 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.906 0.384 . . . . 0.0 111.149 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -55.53 123.31 13.55 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.291 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.8 157.13 4.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 120.988 0.423 . . . . 0.0 110.987 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -71.71 146.76 47.98 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.585 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.31 -52.84 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.152 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 67.58 59.69 0.48 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.049 0.452 . . . . 0.0 111.597 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 57.51 39.73 27.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.202 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 175.75 166.7 33.64 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.128 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 33.6 mtm 57.1 61.94 2.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.865 0.364 . . . . 0.0 111.966 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.592 ' C ' ' HG2' ' A' ' 54' ' ' GLU . 8.0 p -163.0 146.86 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.715 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 0.0 OUTLIER 49.67 -173.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.731 179.455 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.516 HG23 ' CE2' ' A' ' 72' ' ' TRP . 0.6 OUTLIER -139.65 -71.94 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.865 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 60.49 122.79 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 13.2 tpp180 -174.74 142.84 0.73 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 36.6 t80 70.84 -51.7 0.68 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 126.68 33.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.042 0.449 . . . . 0.0 111.974 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.26 149.75 24.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.074 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -122.91 -20.65 5.76 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.712 ' HA ' ' HB2' ' A' ' 68' ' ' GLU . 2.8 p30 -52.88 159.39 1.15 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.429 0.633 . . . . 0.0 112.672 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.448 ' HA3' HG11 ' B' ' 146' ' ' VAL . . . 167.39 -22.44 0.11 Allowed Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.527 -0.76 . . . . 0.0 114.353 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 95.8 p -171.55 -179.71 2.63 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 117.983 0.891 . . . . 0.0 112.25 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 70.67 28.16 3.55 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.177 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 53.49 24.4 4.02 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.423 ' OD2' ' HA ' ' B' ' 139' ' ' LEU . 20.9 t70 -173.63 -141.9 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.916 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.712 ' HB2' ' HA ' ' A' ' 62' ' ' ASN . 2.2 pt-20 -170.11 148.12 3.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.111 0.481 . . . . 0.0 111.513 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.587 ' HA ' ' HG3' ' B' ' 135' ' ' GLU . 2.2 t-20 -83.2 -158.82 0.31 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.902 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.437 ' O ' ' HG3' ' A' ' 61' ' ' MET . 22.9 mttt -101.09 172.52 6.96 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.495 0.664 . . . . 0.0 112.663 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -115.64 -35.87 4.41 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.533 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.715 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.398 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.35 175.73 8.89 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.557 0.218 . . . . 0.0 110.781 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.767 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 2.9 tt0 -122.49 119.88 32.24 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.076 0.465 . . . . 0.0 111.725 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.69 ' O ' " H3'" ' D' ' 191' ' ' ' DT' . 9.9 ttt85 -79.64 117.95 21.02 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.795 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.705 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -111.07 116.64 53.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.741 -179.656 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.842 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.11 126.06 54.21 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -176.26 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.512 ' CG2' ' O ' ' B' ' 107' ' ' VAL . 0.2 OUTLIER -100.86 85.78 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 175.425 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.902 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -56.03 98.39 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -179.655 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.67 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 14.9 p -110.36 -137.75 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.562 -175.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.62 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 31.1 t70 89.14 -7.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -174.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.429 ' OG ' ' NZ ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -120.61 -65.51 1.14 Allowed 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.313 -1.312 . . . . 0.0 107.912 176.892 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.676 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -38.72 -84.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.244 0.34 . . . . 0.0 111.26 179.621 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.3 OUTLIER 173.9 45.86 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 121.123 0.487 . . . . 0.0 110.937 179.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.81 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.7 OUTLIER -83.35 -40.86 18.89 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.588 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.82 -40.59 21.54 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.707 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 36' ' ' ALA . 1.4 mt -50.33 -33.48 20.38 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.3 OUTLIER -78.4 -51.11 10.54 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.522 0.677 . . . . 0.0 111.648 178.705 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.616 ' HG2' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -70.46 -25.88 63.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.459 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.45 -27.85 50.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.019 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.742 ' CE2' HD11 ' A' ' 39' ' ' LEU . 2.8 m-30 -88.47 -40.75 13.23 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.303 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.3 t0 115.31 57.74 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.155 0.978 . . . . 0.0 111.547 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.483 ' HB ' HD11 ' B' ' 117' ' ' LEU . 92.0 t -118.34 -19.86 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.043 -179.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.44 ' O ' HD13 ' B' ' 124' ' ' ILE . 36.0 m-20 41.38 23.25 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.799 0.333 . . . . 0.0 111.562 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.81 HG12 ' CE ' ' A' ' 32' ' ' MET . 2.4 pp 21.99 45.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 177.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.71 ' HA ' HG23 ' A' ' 7' ' ' VAL . 13.3 p -62.97 -63.72 1.12 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.813 176.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.443 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -81.15 -16.56 74.11 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.769 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.617 ' CD1' ' HG2' ' A' ' 35' ' ' GLU . 1.9 tp -66.82 -52.91 38.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.73 0.265 . . . . 0.0 111.235 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.736 ' O ' ' HG2' ' B' ' 132' ' ' MET . 35.0 t -53.57 -67.69 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.703 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 4.6 p -50.8 -36.64 38.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -63.06 -51.68 65.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.567 HG21 ' OG1' ' A' ' 31' ' ' THR . 18.8 m -58.22 -31.73 67.63 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.081 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.803 ' HE3' ' CG2' ' A' ' 24' ' ' ILE . 5.4 mmt -65.54 -54.71 24.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.482 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.407 ' HA ' ' HB1' ' B' ' 136' ' ' ALA . 9.7 tt0 -49.94 -41.53 46.56 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.19 -54.0 44.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 116.833 -0.167 . . . . 0.0 110.749 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.587 ' HG3' ' HA ' ' A' ' 69' ' ' ASN . 3.1 mt-10 -75.08 -8.84 57.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.551 178.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.465 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -79.47 -47.31 15.85 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.224 -1.399 . . . . 0.0 107.224 176.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.9 74.54 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.398 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' B' ' 139' ' ' LEU . 7.7 tpt180 -63.44 -42.12 98.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.219 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.528 HD13 ' HB3' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -16.66 116.73 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.936 0.894 . . . . 0.0 113.059 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -156.71 -62.88 0.1 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.134 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -164.91 163.99 20.87 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.011 0.434 . . . . 0.0 111.751 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.442 ' O ' ' NH1' ' B' ' 143' ' ' ARG . 1.9 pm0 -96.18 -173.67 2.87 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.978 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.442 ' NH1' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -176.12 -152.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 178.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.42 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 1.3 p90 -147.1 143.19 28.12 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.713 0.292 . . . . 0.0 111.688 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 80.59 105.23 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.128 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.448 HG11 ' HA3' ' A' ' 63' ' ' GLY . 0.2 OUTLIER -121.07 121.67 65.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.829 179.243 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -14.23 49.83 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.9 m120 65.15 45.64 2.95 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.071 0.462 . . . . 0.0 111.619 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.65 120.41 42.14 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . 0.483 ' HG3' ' OD1' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -83.07 172.6 12.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.535 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -70.58 176.85 34.75 Favored Glycine 0 CA--C 1.522 0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.812 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -166.97 55.36 0.08 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.941 0.401 . . . . 0.0 111.995 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . 0.461 HG23 ' CZ3' ' A' ' 72' ' ' TRP . 4.4 p -113.58 88.15 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 121.118 0.485 . . . . 0.0 111.021 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.777 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 11.8 p -159.37 45.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.539 0.685 . . . . 0.0 111.155 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.05 -152.43 0.24 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.424 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.22 174.42 1.33 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.716 0.293 . . . . 0.0 110.862 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.99 95.45 0.12 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.943 0.402 . . . . 0.0 111.452 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 3.4 tp -163.98 55.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.319 0.581 . . . . 0.0 111.298 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -164.7 159.52 18.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 9.7 mtt -65.36 86.07 0.07 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.049 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -75.58 165.76 24.59 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.124 0.488 . . . . 0.0 112.062 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 142.36 -136.71 7.38 Favored Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.257 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' B' ' 165' ' ' PHE . 38.3 t 61.0 -149.96 0.41 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.404 ' N ' ' OG ' ' B' ' 164' ' ' SER . 90.9 t80 -133.22 -54.54 0.91 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -122.53 -96.72 0.46 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.489 ' OD1' ' HB3' ' A' ' 39' ' ' LEU . 6.6 t0 -87.25 93.17 9.31 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.244 0.545 . . . . 0.0 111.503 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -169.59 92.27 0.24 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.388 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.3 t30 -173.15 -168.35 0.46 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.772 0.32 . . . . 0.0 111.614 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -167.18 92.53 0.42 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.127 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -96.01 -83.68 0.37 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.966 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.363 -0.827 . . . . 0.0 111.82 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.875 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.527 0.873 0 C3'-C2'-C1' 105.538 2.027 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.799 " O4'" " H1'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.526 0.791 0 C3'-C2'-C1' 106.067 2.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.485 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C4'-C3'-C2' 104.203 1.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.58 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.949 0 C1'-O4'-C4' 107.527 -1.552 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.498 " H2'" ' C7 ' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.027 0 C3'-C2'-C1' 105.382 1.916 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.708 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C4'-C3'-C2' 104.348 1.148 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.708 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.741 0 C3'-C2'-C1' 105.582 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.483 ' H72' ' C8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.301 0.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.454 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.703 0 C3'-C2'-C1' 104.249 1.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.493 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.794 0 C3'-C2'-C1' 105.306 1.862 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.493 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 N19-C1'-C2' 113.272 -0.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.455 ' C5 ' ' C2 ' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 O4'-C4'-C3' 106.116 0.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 107.459 1.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.88 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 N19-C1'-C2' 116.251 1.282 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.521 ' O2 ' ' H72' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.61 -0.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.482 ' C8 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.622 0 O4'-C1'-C2' 106.872 0.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.473 ' P ' ' HD2' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C4'-C3'-C2' 104.281 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.567 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.909 0 C1'-O4'-C4' 107.016 -1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.69 " H3'" ' O ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.603 0 C3'-C2'-C1' 105.139 1.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.349 1.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.624 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.746 0 C3'-C2'-C1' 105.606 2.076 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.624 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 C3'-C2'-C1' 104.599 1.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.53 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.879 0 C4'-C3'-C2' 104.573 1.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.447 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.494 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.737 0 O4'-C1'-C2' 104.807 -1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.494 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C1'-O4'-C4' 110.32 0.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.476 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 120.772 0.32 . . . . 0.0 111.478 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER 73.74 115.02 0.06 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.717 -179.511 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' B' ' 109' ' ' VAL . 1.2 tt0 -95.89 106.56 18.72 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.446 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.799 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.7 OUTLIER -78.87 99.86 6.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.738 -179.486 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.675 HG23 ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -102.96 110.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 177.426 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.668 ' CG2' ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.5 123.65 47.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 -175.645 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.519 ' O ' HG22 ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.16 105.66 17.96 Favored 'Isoleucine or valine' 0 C--N 1.344 0.337 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 176.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.596 HG21 ' HG3' ' B' ' 104' ' ' ARG . 2.0 p -70.08 90.46 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.725 HG22 ' CB ' ' A' ' 14' ' ' TYR . 9.1 t -78.08 -125.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.754 -177.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.561 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.6 t70 86.28 -5.34 0.76 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.292 0.568 . . . . 0.0 110.316 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.8 t -144.92 -52.0 0.28 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.335 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.755 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -44.78 -90.89 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.623 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m 177.85 34.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.392 -0.818 . . . . 0.0 111.133 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.725 ' CB ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -84.05 -46.1 12.36 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.032 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.12 -42.28 28.79 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.977 -176.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.588 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -60.29 -57.92 10.73 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.556 0.616 . . . . 0.0 111.82 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.765 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -60.34 -35.76 76.4 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.633 -178.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.74 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.74 -32.13 41.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.373 0.606 . . . . 0.0 112.117 -179.522 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.622 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -82.1 -16.88 48.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.267 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.553 ' CD1' ' HB2' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -87.98 -33.32 18.45 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.212 179.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.729 ' HB3' ' HB3' ' A' ' 67' ' ' ASP . 0.5 OUTLIER 172.88 -19.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.74 ' O ' ' HA ' ' A' ' 18' ' ' LYS . 17.0 t -97.19 -179.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.255 0.55 . . . . 0.0 110.168 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.589 ' O ' HD12 ' A' ' 24' ' ' ILE . 20.8 m120 -160.67 43.94 0.19 Allowed 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 177.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.687 ' CG2' ' HE2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 46.96 -4.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 113.022 -1.899 . . . . 0.0 115.921 -177.45 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.616 ' OG ' " H4'" ' D' ' 189' ' ' ' DG' . 1.4 t -39.02 -63.79 0.5 Allowed 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.09 0.859 . . . . 0.0 109.675 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.554 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -86.76 -25.36 35.39 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.941 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.761 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -59.49 -62.36 1.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.438 0.619 . . . . 0.0 110.279 179.623 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.602 ' CG1' ' HE1' ' A' ' 32' ' ' MET . 16.2 t -50.59 -59.26 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.787 0.804 . . . . 0.0 109.383 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.739 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 1.4 t -50.12 -52.58 33.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.0 OUTLIER -74.14 -50.96 17.12 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 117.762 0.255 . . . . 0.0 110.435 -177.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.552 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -54.17 -49.16 69.93 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.916 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.892 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 14.9 mtt -54.77 -48.16 73.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.189 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -45.35 73.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.413 0.149 . . . . 0.0 110.778 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -61.93 -57.1 13.03 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -58.27 -33.61 69.6 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.692 178.449 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.581 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -70.41 -48.81 54.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.519 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -52.63 64.78 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.369 0.604 . . . . 0.0 111.135 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -78.57 -18.02 55.27 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.918 -177.669 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.65 ' CD2' ' CD2' ' B' ' 120' ' ' TYR . 0.8 OUTLIER -20.95 106.89 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.515 0.726 . . . . 0.0 112.327 -179.732 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.532 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 31.1 mtm-85 95.25 -10.66 0.1 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.636 0.775 . . . . 0.0 112.623 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 38' ' ' ARG . . . -129.07 -174.26 3.21 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.714 0.292 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.48 -163.16 1.63 Allowed 'General case' 0 CA--C 1.538 0.498 0 O-C-N 122.367 -0.208 . . . . 0.0 111.406 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.88 43.88 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.848 0.356 . . . . 0.0 111.53 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.0 60.86 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.86 138.43 15.04 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.938 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.472 HG23 HG21 ' A' ' 55' ' ' VAL . 7.2 p -130.91 133.17 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.38 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -103.96 110.42 22.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.26 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -171.55 -72.41 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.81 -179.98 5.81 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.004 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -75.18 67.81 1.86 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.137 0.494 . . . . 0.0 111.072 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.12 148.16 20.65 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.598 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 65.7 mtm -81.09 -71.67 0.46 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.3 t -135.5 -27.51 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.912 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.58 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.3 pm0 -81.52 131.56 35.28 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.215 0.531 . . . . 0.0 111.87 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.472 HG21 HG23 ' A' ' 46' ' ' VAL . 2.9 p -125.01 82.96 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.441 0.639 . . . . 0.0 110.594 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -109.02 134.89 51.06 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.854 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.41 148.17 0.34 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.415 ' C ' HG13 ' A' ' 59' ' ' ILE . 0.7 OUTLIER 77.96 134.96 0.06 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.415 HG13 ' C ' ' A' ' 58' ' ' PHE . 1.1 mp -141.63 114.48 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.608 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.17 63.39 0.51 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.153 0.502 . . . . 0.0 111.974 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 41.5 tpp 54.73 71.33 0.54 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.173 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.97 -150.37 0.35 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.429 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -112.46 110.73 2.65 Favored Glycine 0 C--N 1.338 0.643 0 C-N-CA 120.68 -0.772 . . . . 0.0 113.395 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -78.18 -52.39 8.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 110.581 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -119.56 171.63 8.23 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.251 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.38 -9.05 21.49 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.729 ' HB3' ' HB3' ' A' ' 21' ' ' ASP . 5.7 p-10 -101.74 168.85 9.19 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.444 ' HB3' ' NH1' ' B' ' 143' ' ' ARG . 26.7 tt0 64.6 69.02 0.52 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.947 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.35 72.72 1.41 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.76 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 5.5 tttm -65.24 -21.78 66.79 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -178.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.624 ' HA ' ' CE3' ' B' ' 144' ' ' TRP . 1.6 t70 78.36 -172.84 0.07 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.121 0.419 . . . . 0.0 111.159 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.58 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 27.3 p-90 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.677 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 4.2 mmm . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 120.628 0.252 . . . . 0.0 111.632 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.53 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 18.4 mttm -75.87 -175.24 2.92 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.637 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.561 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 43.5 tp60 -124.45 123.41 40.1 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.653 0.263 . . . . 0.0 110.99 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.596 ' HG3' HG21 ' A' ' 8' ' ' THR . 5.8 ttm105 -85.92 116.45 24.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.354 0.597 . . . . 0.0 111.949 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.678 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -114.45 125.78 71.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 177.296 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.668 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.04 125.72 33.99 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.373 -0.531 . . . . 0.0 112.354 -176.728 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 24' ' ' ILE . 0.9 OUTLIER -102.65 98.46 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 175.19 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.799 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 76.5 p -70.27 93.42 0.84 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.523 0.678 . . . . 0.0 110.816 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.714 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 1.9 t -85.55 -141.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.008 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.515 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.0 t0 91.01 -9.69 0.28 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 5.2 m -129.03 -56.63 1.18 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.196 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.739 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 1.2 m-20 -54.68 -104.19 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -167.14 29.24 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.018 -1.051 . . . . 0.0 111.661 -179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.852 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -72.73 -38.7 67.35 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.647 1.179 . . . . 0.0 112.864 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.607 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.99 -42.27 37.29 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -175.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.581 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -56.37 -34.55 66.76 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.35 0.977 . . . . 0.0 112.857 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.892 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -70.93 -52.36 20.42 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.97 0.414 . . . . 0.0 110.68 179.528 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.86 -25.69 66.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.446 0.641 . . . . 0.0 109.467 177.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -64.08 -33.25 75.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.957 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.65 ' CD2' ' CD2' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.99 -29.03 21.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.925 -0.56 . . . . 0.0 110.446 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.0 t0 123.58 71.26 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.488 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 0.3 OUTLIER -169.39 -40.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.483 ' HB3' HD13 ' B' ' 124' ' ' ILE . 14.8 m-80 64.47 -106.95 0.16 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.628 HG22 ' HE2' ' A' ' 32' ' ' MET . 0.2 OUTLIER -153.09 1.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 178.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.3 OUTLIER -39.47 -63.76 0.53 Allowed 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.721 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.38 -29.88 23.57 Favored Glycine 0 CA--C 1.522 0.515 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.945 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.527 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 0.0 OUTLIER -56.88 -60.53 3.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.453 0.301 . . . . 0.0 110.813 179.187 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.641 HG21 HG23 ' A' ' 24' ' ' ILE . 2.3 t -53.55 -64.86 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.755 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 12.8 p -49.21 -43.96 42.84 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.8 m -72.18 -48.8 40.57 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.23 -36.87 85.07 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.025 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.765 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 3.7 mmt -64.42 -54.64 29.56 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.946 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.494 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -48.47 -35.67 13.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.806 -179.595 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -66.35 -57.26 7.83 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.08 -13.05 61.12 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.478 0.18 . . . . 0.0 111.189 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.588 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.84 -30.3 20.29 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 121.086 0.47 . . . . 0.0 109.807 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -82.29 -48.26 11.42 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.71 0.767 . . . . 0.0 110.686 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -17.46 61.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 114.028 -1.442 . . . . 0.0 114.095 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.483 ' CD2' ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -41.82 149.68 0.13 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.609 0.641 . . . . 0.0 112.521 -178.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER 85.45 73.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.081 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -170.07 -149.53 0.07 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.506 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 172.77 13.26 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.954 0.407 . . . . 0.0 111.341 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.444 ' NH1' ' HB3' ' A' ' 68' ' ' GLU . 6.0 mmm180 -79.59 -54.4 5.93 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.618 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.624 ' CE3' ' HA ' ' A' ' 71' ' ' ASP . 3.8 m-90 61.68 -166.56 0.21 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.461 ' CB ' ' O ' ' B' ' 144' ' ' TRP . 1.4 tppt? 89.48 75.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.077 0.551 . . . . 0.0 110.783 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.597 ' C ' ' HG2' ' B' ' 147' ' ' GLU . 8.7 p -133.08 169.81 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.549 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.597 ' HG2' ' C ' ' B' ' 146' ' ' VAL . 0.0 OUTLIER 42.33 68.61 0.46 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.219 0.608 . . . . 0.0 112.546 -179.737 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -117.21 50.73 1.07 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.7 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -141.31 160.02 40.99 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.821 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 51.47 48.31 23.18 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.063 0.458 . . . . 0.0 111.269 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -52.37 98.29 0.03 OUTLIER Glycine 0 C--N 1.339 0.701 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.009 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.2 mtt -48.33 151.88 0.98 Allowed 'General case' 0 C--O 1.239 0.513 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 21.6 t -152.94 100.05 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.87 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.511 ' HB3' ' HB3' ' B' ' 172' ' ' TRP . 5.6 tp10 -68.08 -55.1 13.75 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.464 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 3.5 t 65.17 42.82 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.438 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.4 ' N ' ' CD1' ' B' ' 172' ' ' TRP . . . -53.46 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -177.13 171.86 2.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.849 -0.16 . . . . 0.0 110.876 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -64.72 93.96 0.12 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.802 0.334 . . . . 0.0 110.396 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 tt -129.73 11.05 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.282 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -126.7 -119.41 0.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.861 -0.154 . . . . 0.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.7 mtm -102.05 -83.55 0.46 Allowed 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.255 -0.278 . . . . 0.0 110.627 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -166.7 93.93 0.49 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 111.278 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -90.23 20.52 36.62 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.549 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 1.1 m -109.03 33.33 4.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.057 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -121.32 -73.69 0.64 Allowed 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' A' ' 40' ' ' ARG . . . -154.11 -127.57 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.443 0.163 . . . . 0.0 111.155 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -81.99 78.98 8.62 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.094 0.474 . . . . 0.0 111.607 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -165.47 115.93 1.07 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.17 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 177.83 172.71 0.6 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.142 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -159.28 100.36 1.52 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 111.515 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.26 -154.9 0.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.073 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.511 ' HB3' ' HB3' ' B' ' 154' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.508 -0.758 . . . . 0.0 111.472 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.883 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C4'-C3'-C2' 102.597 -0.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.636 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C4'-C3'-C2' 102.759 -0.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.496 ' C5 ' ' C4 ' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 104.54 1.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.496 ' C4 ' ' C5 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.892 0 C4'-C3'-C2' 104.2 1.0 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.459 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.895 0 C4'-C3'-C2' 104.746 1.546 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.544 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 104.591 1.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.544 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.565 0 C3'-C2'-C1' 104.63 1.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.493 ' C4 ' ' C5 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C4'-C3'-C2' 104.331 1.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.603 " O5'" ' H8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.515 0 O4'-C1'-C2' 107.188 0.989 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.622 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 105.895 2.282 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.645 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 C3'-C2'-C1' 104.791 1.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.645 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 N19-C1'-C2' 115.209 0.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 O4'-C1'-C2' 106.977 0.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.883 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C1'-C2' 107.082 0.892 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 106.97 0.791 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C4'-C3'-C2' 102.75 -0.45 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.686 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 C4'-C3'-C2' 101.744 -1.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.686 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C4'-C3'-C2' 104.696 1.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.488 ' C7 ' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C4'-C3'-C2' 104.543 1.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.425 ' N1 ' ' N3 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.934 0 C1'-O4'-C4' 107.477 -1.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.735 0 C4'-C3'-C2' 105.039 1.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.583 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 C3'-C2'-C1' 104.144 1.032 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.583 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.9 0 C4'-C3'-C2' 104.636 1.436 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.439 ' H8 ' H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.594 0 C3'-C2'-C1' 104.42 1.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.42 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 N19-C1'-C2' 115.376 0.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.437 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 O4'-C4'-C3' 106.15 0.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.655 0.264 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -92.11 -171.24 2.77 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 179.471 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.498 ' O ' ' HA ' ' B' ' 108' ' ' THR . 60.8 tp60 -108.79 111.15 22.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.311 0.577 . . . . 0.0 112.095 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.744 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.0 ttm-85 -79.36 103.6 9.4 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.64 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.753 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.4 OUTLIER -98.1 130.34 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.066 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.076 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.749 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -131.32 130.07 42.27 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 117.799 -1.561 . . . . 0.0 114.191 -177.745 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.742 ' HB ' HG21 ' B' ' 105' ' ' ILE . 0.9 OUTLIER -100.63 108.05 22.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.191 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.076 177.303 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.16 87.5 0.79 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.806 0.813 . . . . 0.0 109.477 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.716 ' CG2' ' CD2' ' A' ' 14' ' ' TYR . 4.7 m -71.43 -155.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.271 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.654 ' CB ' ' HA ' ' B' ' 102' ' ' LYS . 22.3 t70 91.24 -19.04 0.14 Allowed 'General case' 0 C--N 1.35 0.626 0 C-N-CA 123.689 0.795 . . . . 0.0 109.783 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 4.3 m -110.26 -69.6 0.86 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.852 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.653 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -51.69 -88.71 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.573 ' CB ' ' CB ' ' B' ' 133' ' ' GLN . 1.3 m 175.29 46.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.323 0.965 . . . . 0.0 111.874 -178.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.77 ' CE1' ' CG1' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -82.44 -44.72 15.69 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -179.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.468 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 61.5 mt-30 -47.99 -38.43 16.96 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -175.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.681 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.0 OUTLIER -61.38 -57.38 12.51 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.746 0.703 . . . . 0.0 112.669 -179.718 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.79 ' CB ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -47.31 -48.84 25.04 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.431 0.634 . . . . 0.0 112.128 -178.053 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.578 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 2.9 pttt -78.98 -29.39 43.79 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.262 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.511 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -64.94 -27.46 68.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.715 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.632 ' CD2' ' CD2' ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.33 -43.06 11.8 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.667 -0.683 . . . . 0.0 110.445 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.5 t70 168.98 15.3 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.533 ' CG1' ' HB2' ' A' ' 27' ' ' LEU . 65.7 t -142.4 84.75 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -177.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.578 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -71.77 51.47 0.2 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.206 0.526 . . . . 0.0 110.852 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.787 ' CG2' ' HE1' ' B' ' 132' ' ' MET . 0.9 OUTLIER 40.9 -8.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 118.97 2.952 . . . . 0.0 118.97 179.479 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.518 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 0.2 OUTLIER -38.52 -63.24 0.52 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-N 119.99 1.268 . . . . 0.0 110.439 -179.022 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.1 -28.44 34.08 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.549 178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.599 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 11.3 tp -63.3 -62.19 1.85 Allowed 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.717 0.259 . . . . 0.0 110.692 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.761 HG21 ' CG2' ' B' ' 128' ' ' VAL . 2.3 t -45.65 -64.61 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 O-C-N 123.373 0.421 . . . . 0.0 110.426 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.62 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 4.8 p -49.18 -35.26 16.51 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 123.136 0.273 . . . . 0.0 111.57 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -69.95 -52.15 26.82 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 86.0 m -55.89 -39.02 70.95 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.293 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.858 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.84 -55.51 29.54 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.695 179.198 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -44.87 87.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.103 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.1 -50.82 62.75 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.184 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.492 ' O ' HD23 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -65.64 -33.88 76.91 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.137 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.514 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -61.28 -45.09 95.93 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.77 -51.94 55.03 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.839 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.459 ' NH1' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.72 -35.27 80.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.055 -1.429 . . . . 0.0 113.531 -177.587 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.503 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER -25.04 -56.65 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.73 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.506 ' HD2' ' CE1' ' B' ' 120' ' ' TYR . 0.0 OUTLIER -90.22 57.85 3.87 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.517 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.505 ' CB ' ' O ' ' A' ' 40' ' ' ARG . . . 151.18 98.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.456 0.702 . . . . 0.0 110.935 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.459 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -86.75 -143.17 0.11 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.239 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.99 -133.9 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 122.15 -0.343 . . . . 0.0 110.83 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.486 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 3.4 m95 -127.3 143.69 51.18 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.881 0.372 . . . . 0.0 110.884 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HB2' ' HE3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -106.13 133.34 50.99 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.386 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.0 t 75.97 154.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.025 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.88 35.1 11.19 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.071 0.462 . . . . 0.0 111.357 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 22.2 p-10 -166.35 104.85 0.63 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.193 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -155.03 -168.66 2.95 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.082 0.468 . . . . 0.0 112.119 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.502 ' O ' ' NH1' ' B' ' 138' ' ' ARG . 25.9 mt-10 66.94 -93.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.689 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.44 132.3 0.2 Allowed Glycine 0 CA--C 1.524 0.594 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.528 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.95 169.61 17.31 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.945 0.402 . . . . 0.0 111.743 -179.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.12 -64.36 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.446 ' HA ' ' HB3' ' A' ' 72' ' ' TRP . 2.3 mp0 33.18 55.67 0.47 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.354 0.597 . . . . 0.0 112.029 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.441 HG21 ' NE1' ' A' ' 72' ' ' TRP . 3.9 m -79.49 62.6 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.795 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -86.78 -31.77 20.73 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.177 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -112.34 121.03 43.72 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.299 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.93 -53.96 22.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.48 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.1 mt 66.8 -60.37 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.461 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -120.48 118.42 30.22 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.974 0.416 . . . . 0.0 110.734 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 ptt? -70.92 58.4 0.21 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.091 0.472 . . . . 0.0 111.818 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -106.32 6.99 31.07 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.691 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 59.59 -99.1 0.14 Allowed Glycine 0 C--N 1.338 0.657 0 C-N-CA 121.193 -0.527 . . . . 0.0 113.049 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 41.13 59.96 2.16 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.984 0.421 . . . . 0.0 111.819 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -148.44 142.29 25.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.274 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.38 -83.69 0.39 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.111 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.436 ' O ' ' HB2' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -162.53 129.05 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.36 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' A' ' 67' ' ' ASP . 39.7 tp10 173.56 -72.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.877 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p30 42.17 57.86 3.15 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -167.86 147.76 4.97 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.13 69.21 0.74 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.98 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 5.2 m95 . . . . . 0 C--O 1.252 1.198 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.741 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 120.437 0.161 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.654 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 10.0 mmtt -58.89 153.88 16.34 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.609 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 16.6 tp60 -121.19 125.8 48.08 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 121.66 0.743 . . . . 0.0 111.609 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.445 ' NH2' ' N7 ' ' C' ' 177' ' ' ' DG' . 1.7 ttm180 -83.81 116.62 22.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.317 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.77 ' CG1' ' CE1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -94.53 123.48 46.66 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.313 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.624 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -131.07 111.93 12.44 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.482 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.445 HG12 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.56 98.25 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 175.783 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.744 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 72.1 p -68.25 93.44 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.842 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.671 ' O ' ' HB3' ' B' ' 110' ' ' ASP . 6.3 t -80.57 -125.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.143 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.671 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.6 t70 83.21 -15.22 0.66 Allowed 'General case' 0 C--N 1.349 0.557 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -176.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.11 -59.25 1.42 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.997 177.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.62 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.2 m-20 -46.24 -98.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' MET . 24.9 t -175.6 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.461 -0.774 . . . . 0.0 110.504 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.858 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.0 OUTLIER -81.63 -46.58 14.17 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.014 0.926 . . . . 0.0 113.406 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.507 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.94 -40.78 31.54 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.797 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.66 -25.35 17.66 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.661 0.664 . . . . 0.0 112.385 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.585 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.11 -60.43 2.37 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.711 0.767 . . . . 0.0 110.269 178.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.722 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.7 pttt -62.4 -25.11 67.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.19 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.64 -23.93 19.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.18 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.564 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 65.9 m-85 -87.52 -50.98 6.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.564 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 24.0 t0 136.83 54.52 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 O-C-N 124.726 1.266 . . . . 0.0 109.913 179.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.534 HG12 ' CD1' ' B' ' 117' ' ' LEU . 7.1 p -154.1 87.1 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.095 -178.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.559 ' O ' ' N ' ' B' ' 125' ' ' SER . 0.0 OUTLIER -70.55 52.9 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.774 HG12 ' CE ' ' A' ' 32' ' ' MET . 1.3 pp 29.08 10.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 119.433 3.123 . . . . 0.0 119.433 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.672 ' HA ' HG22 ' A' ' 7' ' ' VAL . 3.2 p -37.24 -60.91 0.62 Allowed 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 122.765 0.426 . . . . 0.0 110.891 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.67 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.95 -19.55 61.05 Favored Glycine 0 C--O 1.222 -0.644 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.279 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.572 ' HB3' HG23 ' B' ' 124' ' ' ILE . 2.7 tm? -67.36 -56.44 9.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 117.151 0.476 . . . . 0.0 110.745 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.761 ' CG2' HG21 ' A' ' 28' ' ' VAL . 95.5 t -59.06 -68.65 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 120.951 0.405 . . . . 0.0 110.157 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.653 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 56.3 p -50.32 -38.24 40.66 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.67 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -82.57 -50.02 9.25 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.177 1.353 . . . . 0.0 111.413 -179.286 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.554 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -51.43 -31.44 22.97 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.973 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.79 ' SD ' ' CB ' ' A' ' 17' ' ' LEU . 2.1 mmt -61.3 -50.57 72.44 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.227 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.573 ' CB ' ' CB ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -49.94 -40.32 43.24 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.518 0.599 . . . . 0.0 111.171 179.4 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -68.18 -49.41 61.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -77.28 -18.94 57.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.862 0.363 . . . . 0.0 110.532 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.681 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -75.21 -34.97 61.53 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.454 ' O ' HD12 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -78.72 -56.14 4.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 121.785 0.802 . . . . 0.0 109.516 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.502 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -64.1 -17.65 63.64 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 114.016 -1.447 . . . . 0.0 114.781 -177.506 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.656 HD11 ' HD2' ' B' ' 140' ' ' ARG . 0.2 OUTLIER -44.48 -26.85 0.39 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -178.435 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.656 ' HD2' HD11 ' B' ' 139' ' ' LEU . 1.4 mpt_? -129.82 153.85 47.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.025 0.44 . . . . 0.0 111.298 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -80.31 111.57 16.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.269 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.13 79.12 1.65 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.356 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 9.5 ttm180 -175.93 141.33 0.46 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.526 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.543 ' O ' ' HB3' ' B' ' 145' ' ' LYS . 2.0 t90 -101.37 134.79 43.91 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.151 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.543 ' HB3' ' O ' ' B' ' 144' ' ' TRP . 1.9 tmpt? 74.99 136.57 0.06 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.336 0.397 . . . . 0.0 110.264 -178.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 10.9 m -132.45 128.21 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -168.39 1.95 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.648 179.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -145.72 133.85 21.56 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 111.98 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -150.76 110.96 4.15 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.659 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -154.15 166.66 32.38 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.959 0.409 . . . . 0.0 111.389 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 130.61 -84.02 0.31 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.266 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 61.66 -161.1 0.3 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.748 0.308 . . . . 0.0 111.523 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 2.8 t 61.85 57.34 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.206 0.526 . . . . 0.0 111.316 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -51.32 70.0 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.521 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.483 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 8.8 t 67.71 53.85 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-O 121.446 0.641 . . . . 0.0 111.865 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.415 ' N ' ' CD1' ' B' ' 172' ' ' TRP . . . -72.58 173.89 8.29 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 32.3 mmt-85 -93.7 -45.87 7.5 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.192 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 68.81 176.85 0.27 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.995 0.426 . . . . 0.0 111.894 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -144.37 -56.29 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.561 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.71 147.1 29.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -84.85 0.39 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.155 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.89 -163.22 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.557 0.218 . . . . 0.0 111.337 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 146.66 -173.16 26.99 Favored Glycine 0 C--N 1.337 0.617 0 C-N-CA 120.474 -0.87 . . . . 0.0 114.025 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 1.3 m -103.33 -95.82 0.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.204 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -151.91 67.58 0.87 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.025 0.441 . . . . 0.0 111.704 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . 59.95 17.09 6.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 111.575 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.03 -96.42 0.47 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.363 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.54 86.88 0.2 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.187 0.518 . . . . 0.0 110.254 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -167.74 161.59 13.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.413 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.505 ' O ' ' HE3' ' B' ' 170' ' ' LYS . 0.1 OUTLIER 79.85 83.58 0.05 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.691 179.327 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -141.4 -168.33 2.61 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.57 179.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.483 ' CE2' ' HA ' ' B' ' 155' ' ' VAL . 1.9 m-90 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.724 -0.655 . . . . 0.0 111.86 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.878 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.755 0 C3'-C2'-C1' 105.939 2.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.676 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 C4'-C3'-C2' 101.763 -1.437 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.676 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.508 0 C3'-C2'-C1' 104.714 1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.428 ' H73' " H2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.865 0 O4'-C1'-C2' 104.847 -1.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.574 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.95 0 C4'-C3'-C2' 104.624 1.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.58 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.992 0 C1'-O4'-C4' 107.294 -1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.627 ' C2 ' ' C2 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.552 0 C3'-C2'-C1' 104.663 1.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.569 ' C4 ' ' C5 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 103.966 0.766 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.441 " O5'" ' H8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 C3'-C2'-C1' 104.072 0.98 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.634 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.764 0 C3'-C2'-C1' 105.485 1.989 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.634 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O4'-C1'-C2' 107.14 0.945 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.627 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 101.491 -0.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . 0.431 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 110.271 0.408 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.872 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.715 0.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.432 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 N19-C1'-C2' 113.242 -0.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.54 H2'' ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 C3'-C2'-C1' 104.256 1.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.54 ' C8 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C4'-C3'-C2' 104.215 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.61 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C3'-C2'-C1' 105.383 1.916 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.61 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 O4'-C4'-C3' 104.229 -1.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.558 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.685 0 C3'-C2'-C1' 104.121 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 C4'-C3'-C2' 104.973 1.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.635 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C3'-C2'-C1' 104.214 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.635 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C1'-O4'-C4' 107.348 -1.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.246 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.491 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 N19-C1'-C2' 115.362 0.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.404 ' C2 ' ' N1 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C4'-C3'-C2' 103.73 0.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ttp . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.385 0.136 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 5.2 mtmt -116.96 152.9 33.58 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.581 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.674 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 20.1 tp60 -118.46 113.78 21.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.029 0.442 . . . . 0.0 111.08 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.808 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.96 107.98 13.17 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.746 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.677 HG13 ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.78 128.05 69.69 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.772 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -127.87 136.26 51.16 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.53 -177.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.533 HG11 HD11 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.65 106.89 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.326 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 3.2 p -70.37 91.74 0.77 Allowed 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.721 -0.392 . . . . 0.0 109.957 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.647 HG22 ' CB ' ' A' ' 14' ' ' TYR . 2.3 t -85.39 -139.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.112 -178.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.481 ' H ' ' CG1' ' A' ' 9' ' ' VAL . 24.8 t0 92.32 -10.4 0.2 Allowed 'General case' 0 C--N 1.35 0.606 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -175.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 m -129.67 -54.06 1.15 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.06 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.727 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -48.1 -99.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.484 ' N ' ' HB2' ' B' ' 129' ' ' SER . 0.2 OUTLIER -176.28 37.64 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.32 -0.863 . . . . 0.0 110.734 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.883 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -82.75 -35.27 26.76 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.368 1.067 . . . . 0.0 113.786 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.494 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.95 -46.25 43.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.532 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -50.64 -33.32 21.9 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.88 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 2.2 mt -74.52 -60.07 2.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.361 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.98 -26.29 68.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.716 0.77 . . . . 0.0 109.815 178.384 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -31.61 72.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.883 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.743 ' CE2' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.24 -38.73 15.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.331 179.491 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 29.8 t70 146.83 31.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.553 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 54.6 t -161.61 99.85 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 O-C-N 122.254 -0.279 . . . . 0.0 111.071 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.495 ' HB3' HD11 ' A' ' 24' ' ' ILE . 42.3 m-80 -54.3 -88.34 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.677 ' CG2' ' HE2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -161.4 7.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.5 p -38.72 -62.74 0.58 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.551 0.614 . . . . 0.0 110.748 -177.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.4 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -84.18 -30.52 28.0 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.722 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.62 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 1.1 tm? -59.8 -59.91 4.68 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.782 0.291 . . . . 0.0 110.769 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.644 ' O ' ' HG2' ' A' ' 32' ' ' MET . 3.8 t -49.71 -65.4 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.902 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.742 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -49.22 -41.06 36.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.3 m -67.69 -54.08 22.43 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.415 ' OG1' HG22 ' B' ' 131' ' ' THR . 0.4 OUTLIER -61.99 -40.01 94.16 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.088 -179.454 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.834 ' HE1' ' CG1' ' B' ' 124' ' ' ILE . 3.5 mmt -57.97 -58.05 10.1 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.677 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.1 OUTLIER -51.86 -37.91 53.97 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.118 0.417 . . . . 0.0 111.398 179.804 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.04 -55.38 7.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.813 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -21.47 64.8 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.047 0.451 . . . . 0.0 109.81 178.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.702 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.44 -49.18 28.26 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -51.12 69.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.769 0.795 . . . . 0.0 109.324 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.82 -49.02 74.49 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.173 -178.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.611 HD13 ' CB ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 20.08 77.72 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.866 0.866 . . . . 0.0 112.629 179.636 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.92 -53.68 0.81 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.212 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -155.54 -105.34 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 67.23 142.62 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.235 0.541 . . . . 0.0 111.667 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.33 179.52 7.87 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.95 -178.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.44 -170.6 1.82 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.278 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.94 -67.39 0.22 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -133.2 123.57 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.856 0.36 . . . . 0.0 111.609 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.523 ' HG2' ' HA2' ' B' ' 151' ' ' GLY . 0.0 OUTLIER -47.94 -65.68 0.53 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.674 179.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.76 43.3 25.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.956 0.408 . . . . 0.0 111.219 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.92 78.37 3.49 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.83 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -109.72 118.56 36.86 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.069 0.461 . . . . 0.0 111.249 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -155.27 -167.39 16.83 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.65 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.6 mmm 61.22 21.5 11.95 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 p -162.17 123.52 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.984 0.421 . . . . 0.0 111.203 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.09 158.12 27.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.834 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -145.48 62.87 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.971 0.415 . . . . 0.0 111.715 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.04 77.42 0.23 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.819 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -151.95 158.83 43.67 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.377 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 1.4 m-85 74.78 154.7 0.16 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.011 0.434 . . . . 0.0 111.513 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.6 mt -123.28 104.69 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.821 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.17 78.66 1.61 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.634 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 10.1 mmt -152.78 125.86 8.54 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.277 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.37 53.15 0.89 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.392 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -177.07 -64.46 0.06 OUTLIER Glycine 0 CA--C 1.524 0.615 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.836 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.91 -84.63 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 122.366 0.267 . . . . 0.0 110.65 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 55.51 24.38 6.8 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -154.77 28.68 0.43 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.659 0.266 . . . . 0.0 111.672 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 67.87 148.78 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.242 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.95 -173.7 0.13 Allowed 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.355 0.598 . . . . 0.0 112.016 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -146.35 60.82 1.23 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.042 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -133.84 154.8 50.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.0 0.429 . . . . 0.0 111.721 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -179.46 159.58 0.92 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.961 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 25.9 p-90 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.001 -1.0 . . . . 0.0 111.216 179.812 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 120.275 0.083 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 9.3 mmtm 71.21 113.85 0.05 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.594 0.559 . . . . 0.0 110.518 -179.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.598 ' OE1' HG22 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -95.98 114.88 26.64 Favored 'General case' 0 CA--C 1.495 -1.157 0 CA-C-O 121.094 0.473 . . . . 0.0 111.979 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.656 ' CZ ' HG23 ' A' ' 6' ' ' THR . 7.4 ttt-85 -79.31 98.97 6.89 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.658 -0.817 . . . . 0.0 108.998 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.63 HG23 ' CG ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -99.02 110.69 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.772 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -116.25 120.4 38.84 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.127 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.67 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.19 109.56 25.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 174.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.808 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.1 p -70.28 80.38 0.53 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.698 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 8.4 p -87.97 -140.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.358 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.674 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 3.3 t70 86.44 -3.9 0.72 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 122.103 0.954 . . . . 0.0 108.854 -175.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.32 -64.91 1.09 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.152 177.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.742 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -44.48 -85.85 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.038 -179.212 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.613 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 2.2 m 176.38 39.51 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 119.011 0.823 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.698 ' HB3' ' CG2' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.58 -43.22 15.91 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.598 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.8 OUTLIER -47.65 -39.26 16.65 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -174.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.702 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.7 -56.04 26.78 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.444 1.02 . . . . 0.0 111.734 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.812 ' CB ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -52.11 -43.56 64.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.998 -178.326 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.616 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -79.26 -31.97 43.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.492 179.007 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' B' ' 115' ' ' GLN . . . -57.3 -30.21 64.55 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.493 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.652 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.45 -46.26 9.28 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 118.366 -0.826 . . . . 0.0 109.731 178.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 155.95 32.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.411 HG11 HD12 ' B' ' 117' ' ' LEU . 46.4 t -145.88 84.53 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.544 ' O ' HD12 ' B' ' 124' ' ' ILE . 53.4 m-80 -68.95 61.22 0.1 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.076 0.465 . . . . 0.0 110.887 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.834 ' CG1' ' HE1' ' A' ' 32' ' ' MET . 0.7 OUTLIER 42.57 -6.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -179.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.486 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.88 -62.86 0.58 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.789 1.177 . . . . 0.0 110.274 -179.008 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.05 -29.7 24.96 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.482 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.692 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -59.22 -61.16 2.84 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.827 0.451 . . . . 0.0 110.233 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.621 HG21 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -49.64 -59.23 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.563 179.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.727 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.0 p -50.0 -39.77 42.36 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 52.2 m -70.14 -50.35 41.36 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.415 HG22 ' OG1' ' A' ' 31' ' ' THR . 6.8 m -61.63 -43.73 98.31 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.086 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.883 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.0 mtt -59.54 -57.5 12.68 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.104 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -42.86 71.31 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.163 0.289 . . . . 0.0 111.393 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -66.76 -53.08 36.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.561 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.592 ' O ' HD13 ' B' ' 139' ' ' LEU . 5.7 tp10 -64.07 -32.67 74.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.62 ' O ' ' HB2' ' B' ' 139' ' ' LEU . . . -68.05 -50.9 52.41 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.272 0.629 . . . . 0.0 111.18 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -52.39 63.83 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -53.0 -44.95 67.64 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.458 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.743 HD11 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -36.09 -51.71 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.515 0.726 . . . . 0.0 112.35 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 111.76 24.59 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.004 0.43 . . . . 0.0 111.847 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.72 112.66 2.35 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.002 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -153.77 151.23 29.34 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.084 0.469 . . . . 0.0 111.282 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -106.68 -29.75 9.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.302 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -51.18 107.93 0.21 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.75 131.24 12.18 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.883 0.373 . . . . 0.0 111.688 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' B' ' 147' ' ' GLU . 7.5 p -96.46 21.58 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.716 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' B' ' 146' ' ' VAL . 0.5 OUTLIER 68.93 -62.67 0.39 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -151.35 169.23 22.48 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.006 0.432 . . . . 0.0 111.986 -179.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -119.34 -79.0 0.59 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.783 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.09 -73.05 0.31 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.852 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . 0.523 ' HA2' ' HG2' ' A' ' 47' ' ' GLU . . . 110.21 47.86 0.79 Allowed Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.045 -0.598 . . . . 0.0 113.01 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.0 63.54 1.33 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.853 0.327 . . . . 0.0 111.796 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . 0.416 ' CG1' ' HB3' ' A' ' 47' ' ' GLU . 27.0 m -60.02 -33.64 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.46 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.538 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . 0.0 OUTLIER -98.65 154.67 17.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.881 0.372 . . . . 0.0 110.804 179.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.05 52.96 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.215 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -101.96 119.44 38.8 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.292 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 4.9 ptt85 -71.43 66.03 0.46 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.156 0.503 . . . . 0.0 111.254 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -82.28 175.29 10.39 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.301 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 9.1 tp -128.7 144.36 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.174 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 73.97 168.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.359 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -149.69 26.91 0.82 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -84.08 96.36 8.88 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.29 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -96.23 -85.18 1.73 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.442 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 38.3 t 51.02 38.78 21.47 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -95.29 -68.49 0.8 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.85 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -155.7 -122.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.54 66.64 5.07 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.066 0.46 . . . . 0.0 111.545 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 59.97 -167.49 0.17 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.1 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -150.22 152.53 34.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.249 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.16 137.09 42.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.938 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.67 -179.8 4.98 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.734 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.538 ' HB2' ' HB2' ' B' ' 154' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.08 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.089 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.888 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C1'-O4'-C4' 110.233 0.38 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.744 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C1'-C2' 106.779 0.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.744 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 104.535 1.311 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.461 ' C6 ' H2'' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.704 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.047 0 C4'-C3'-C2' 104.697 1.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.704 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.534 0.649 0 C4'-C3'-C2' 104.154 0.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.589 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.765 0 C3'-C2'-C1' 105.853 2.252 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.909 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C3'-C2'-C1' 101.306 -0.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.909 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 O4'-C1'-C2' 107.159 0.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.606 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.761 0 C3'-C2'-C1' 105.494 1.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.665 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 O4'-C1'-C2' 106.938 0.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.665 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C3'-C2'-C1' 101.94 -0.543 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.267 1.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.887 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 N19-C1'-C2' 115.573 0.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.54 ' C5 ' " H5'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.591 -0.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.933 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C1'-O4'-C4' 110.4 0.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.933 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.509 0 O4'-C1'-C2' 107.128 0.935 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.502 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.877 0 C1'-O4'-C4' 106.406 -2.353 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.581 " H2'" ' C8 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C3'-C2'-C1' 104.829 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.581 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C3'-C2'-C1' 105.01 1.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.653 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.412 -0.619 0 C3'-C2'-C1' 105.182 1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O4'-C1'-C2' 107.462 1.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.469 H2'' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.664 -1.454 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.469 ' C8 ' H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 C3'-C2'-C1' 104.753 1.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.599 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.289 0.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.599 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 C3'-C2'-C1' 101.954 -0.533 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 120.072 -0.013 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.96 161.32 2.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.267 0.354 . . . . 0.0 111.218 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.515 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 44.2 tp60 -123.67 118.44 27.26 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.372 0.606 . . . . 0.0 112.057 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.829 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.04 115.28 18.61 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.308 179.191 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.71 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.7 OUTLIER -110.18 123.24 65.91 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.644 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.31 126.03 34.29 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.579 -177.017 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.559 HG13 ' CD1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -102.13 107.15 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.652 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 3.5 p -70.86 89.38 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.143 0.497 . . . . 0.0 110.864 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.741 HG22 ' CD1' ' A' ' 14' ' ' TYR . 10.9 m -83.25 -150.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.808 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.555 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 25.5 t0 94.82 -7.87 0.11 Allowed 'General case' 0 C--N 1.348 0.519 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -127.98 -59.6 1.18 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.466 -1.243 . . . . 0.0 108.854 176.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.688 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.16 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.566 ' OG ' ' NZ ' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -175.41 38.35 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.288 0.949 . . . . 0.0 111.107 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.802 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -81.98 -44.88 16.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.171 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.55 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 13.1 mt-30 -49.24 -43.72 42.97 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.65 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -53.25 -30.97 41.19 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 118.589 0.632 . . . . 0.0 112.132 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.864 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 1.7 mt -77.78 -51.77 9.99 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.988 0.423 . . . . 0.0 111.69 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.666 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -65.79 -25.35 67.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.411 0.624 . . . . 0.0 110.199 178.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.55 -31.02 55.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.747 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.57 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 46.1 m-85 -88.63 -39.82 13.78 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.22 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.2 t70 118.33 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.474 1.13 . . . . 0.0 110.149 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.6 t -130.59 -47.5 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.156 0 CA-C-N 113.979 -1.464 . . . . 0.0 109.46 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.8 m120 58.3 -113.86 0.73 Allowed 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.111 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.714 HG21 HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.0 -0.45 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 115.872 1.805 . . . . 0.0 115.872 -179.556 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.539 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 9.2 t -39.78 -64.44 0.49 Allowed 'General case' 0 C--O 1.24 0.59 0 C-N-CA 119.575 -0.85 . . . . 0.0 109.968 -178.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.472 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -81.45 -27.06 49.39 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.245 178.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.672 HD22 ' CD1' ' A' ' 17' ' ' LEU . 5.3 tp -62.5 -61.52 2.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.768 0.284 . . . . 0.0 111.008 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.696 HG22 ' HB ' ' A' ' 24' ' ' ILE . 3.7 t -51.83 -70.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.748 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 38.5 p -47.68 -42.53 25.02 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.472 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -74.57 -45.64 44.08 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 119.032 0.833 . . . . 0.0 109.778 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.473 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -68.47 -27.92 66.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.568 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.869 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.5 mmt -57.08 -55.63 32.22 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.368 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.458 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.63 -53.34 53.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.03 0.443 . . . . 0.0 110.42 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.458 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 1.9 m-20 -57.28 -50.83 71.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.049 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.561 ' HG3' HD23 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -68.43 -30.27 69.11 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.13 0.491 . . . . 0.0 109.874 177.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.666 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -67.04 -43.26 83.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.065 0.459 . . . . 0.0 110.374 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.457 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -78.91 -54.67 5.82 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.273 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 9.2 tpp180 -79.31 -31.24 43.17 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 114.662 -1.154 . . . . 0.0 114.039 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.649 ' CD1' ' HB2' ' B' ' 167' ' ' ASP . 0.1 OUTLIER 26.2 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.691 0.758 . . . . 0.0 112.704 -178.289 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.549 ' HB2' ' HG3' ' A' ' 42' ' ' GLU . 8.6 mmm180 -113.01 -18.5 12.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.009 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 58.73 33.31 22.98 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.189 0.519 . . . . 0.0 110.544 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.59 ' HB3' ' CD1' ' A' ' 44' ' ' TRP . 10.4 mt-10 -73.93 72.34 1.6 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.866 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.4 ptp85 -70.72 64.8 0.31 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.358 0.599 . . . . 0.0 110.208 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.652 ' HA ' ' HG2' ' B' ' 149' ' ' GLN . 10.3 m95 -68.64 64.38 0.11 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.342 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.572 ' NZ ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -170.69 154.87 4.6 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.162 0.506 . . . . 0.0 112.165 179.257 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.548 ' N ' ' HD2' ' A' ' 45' ' ' LYS . 5.9 p -162.61 -51.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.058 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -172.25 152.07 2.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.141 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -145.25 86.74 1.78 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 111.929 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -113.07 -34.79 5.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.494 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.51 97.88 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.034 0.445 . . . . 0.0 111.058 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.76 -166.31 20.38 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.124 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.16 95.91 0.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.789 0.328 . . . . 0.0 111.265 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.06 129.36 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.585 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.426 ' O ' HG13 ' A' ' 55' ' ' VAL . 46.0 mm-40 -106.48 -169.44 1.56 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.218 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.793 ' HA ' ' CD1' ' A' ' 72' ' ' TRP . 0.1 OUTLIER -164.44 35.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.107 0.48 . . . . 0.0 111.315 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.73 64.7 0.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.109 0.48 . . . . 0.0 111.441 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.5 38.1 4.18 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.436 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.21 158.39 17.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.048 0.451 . . . . 0.0 111.484 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.9 mm -71.27 73.49 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.034 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -120.92 132.05 54.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.908 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.35 -38.11 74.75 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.742 0.306 . . . . 0.0 110.764 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.86 77.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.261 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -64.77 112.27 4.87 Favored Glycine 0 C--N 1.334 0.467 0 CA-C-N 115.892 -0.595 . . . . 0.0 113.77 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 86.0 p -77.4 76.5 3.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.759 0.314 . . . . 0.0 110.735 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -108.29 -56.18 2.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.273 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.65 -124.6 0.17 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -111.31 -60.0 1.9 Allowed 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.291 -0.255 . . . . 0.0 111.395 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -126.71 -68.19 0.82 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.572 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -66.52 -172.1 0.15 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.387 0.613 . . . . 0.0 112.473 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.98 145.99 44.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.034 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.418 ' HB3' ' HG3' ' A' ' 54' ' ' GLU . 1.5 t70 -101.46 -176.28 3.1 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.884 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.793 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 63.8 t-105 . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.416 0.447 . . . . 0.0 111.015 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.478 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 66.03 156.29 0.1 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.843 0.354 . . . . 0.0 111.064 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.476 ' HB3' HG21 ' A' ' 9' ' ' VAL . 7.8 tt0 -107.03 109.17 20.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.348 0.594 . . . . 0.0 111.45 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.443 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 5.7 ttm180 -78.54 104.82 9.39 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.787 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.641 HG22 ' CD2' ' A' ' 14' ' ' TYR . 5.3 pt -104.94 126.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.647 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -130.58 124.54 32.01 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 119.618 -0.833 . . . . 0.0 112.859 -177.608 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.653 ' HA ' ' OP2' ' D' ' 190' ' ' ' DG' . 0.2 OUTLIER -100.94 103.95 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 173.973 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.829 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 15.9 p -66.24 93.06 0.2 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.921 0.391 . . . . 0.0 110.673 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.645 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 1.4 t -96.49 -135.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.596 -178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 5.4 t70 101.06 12.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 122.623 1.201 . . . . 0.0 108.615 -175.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 44.8 m -159.65 -48.23 0.05 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.065 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.748 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -69.59 50.62 0.1 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.559 ' O ' ' HB3' ' A' ' 32' ' ' MET . 0.1 OUTLIER 57.9 3.05 0.2 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 177.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.769 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.7 t80 -59.08 -56.48 21.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 118.377 0.535 . . . . 0.0 111.817 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.547 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 28.6 mt-30 -48.84 -35.95 15.79 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.666 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -53.69 -43.88 69.28 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.418 0.554 . . . . 0.0 111.218 179.61 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.869 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.3 mt -65.47 -55.38 18.27 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.676 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -66.8 -25.49 66.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.96 179.778 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.36 -25.28 23.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.919 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.696 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.3 m-30 -88.12 -51.24 5.9 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.696 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.9 OUTLIER 132.53 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 O-C-N 125.069 1.481 . . . . 0.0 110.996 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.445 ' CG1' HD23 ' B' ' 117' ' ' LEU . 7.8 p -142.72 -39.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 61.63 -120.96 0.75 Allowed 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.673 ' HB ' HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.48 6.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.452 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.77 -63.92 0.54 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.13 0.491 . . . . 0.0 110.369 -178.253 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.55 -27.66 26.61 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.167 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.645 HD13 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -61.99 -62.22 1.94 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.44 0.296 . . . . 0.0 110.789 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.714 HG21 HG21 ' A' ' 24' ' ' ILE . 2.1 t -50.29 -59.27 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.783 178.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.688 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.5 p -50.39 -38.0 40.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 99.5 m -72.23 -55.6 6.95 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.523 HG21 ' HG ' ' A' ' 27' ' ' LEU . 54.5 m -56.52 -40.28 74.77 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.261 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.864 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -54.17 -56.12 21.27 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.731 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.466 ' OE1' ' HD3' ' A' ' 45' ' ' LYS . 12.6 tt0 -58.33 -37.68 75.61 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.07 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.451 ' O ' HD22 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -66.02 -29.01 69.29 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.883 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.65 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -65.35 -47.75 75.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.95 0.405 . . . . 0.0 110.273 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.431 ' HA ' ' HD3' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -72.76 -50.98 21.01 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.738 0.78 . . . . 0.0 110.386 178.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.598 ' HG3' ' HA ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -71.0 -17.21 62.65 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.078 -1.419 . . . . 0.0 113.78 -177.167 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.558 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -24.63 113.1 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.594 0.358 . . . . 0.0 111.451 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.439 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 0.8 OUTLIER 88.18 94.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.156 -178.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 69.93 129.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.158 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.598 ' HA ' ' HG3' ' B' ' 138' ' ' ARG . 1.6 mp0 -81.07 137.49 36.01 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.098 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 172.83 -164.29 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.298 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 82.2 131.92 0.05 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.161 0.584 . . . . 0.0 112.066 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.58 139.25 38.41 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.926 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 12.4 p 177.29 48.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.525 0.679 . . . . 0.0 110.527 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.433 ' HA ' ' CZ3' ' A' ' 44' ' ' TRP . 1.6 pm0 -70.87 59.8 0.23 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.954 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -145.17 106.53 4.21 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.964 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . 0.652 ' HG2' ' HA ' ' A' ' 44' ' ' TRP . 1.9 tp-100 -158.54 53.32 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.255 0.55 . . . . 0.0 110.661 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -85.21 112.22 20.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.277 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -164.3 131.1 2.34 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.555 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.2 mtt -124.96 139.97 53.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.907 0.384 . . . . 0.0 111.612 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.5 p -174.59 133.57 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.087 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.415 ' HB2' ' CE2' ' B' ' 172' ' ' TRP . 10.1 pt-20 -158.15 172.1 19.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.93 0.395 . . . . 0.0 111.746 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 11.2 t -109.21 -66.99 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.548 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.485 ' HB2' ' HE3' ' B' ' 170' ' ' LYS . . . 68.87 73.89 0.26 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.026 0.441 . . . . 0.0 111.783 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.27 -34.4 10.02 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.052 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -94.14 120.52 34.51 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.718 0.294 . . . . 0.0 110.623 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 6.6 pt -133.24 70.46 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.243 0.544 . . . . 0.0 111.816 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -113.46 160.39 18.5 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.599 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.2 tpp -75.47 60.87 1.22 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.868 0.366 . . . . 0.0 111.05 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -108.0 -70.44 0.8 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.135 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 37.75 -113.3 0.22 Allowed Glycine 0 C--N 1.342 0.914 0 CA-C-N 116.301 -0.408 . . . . 0.0 112.656 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 6.9 m 58.31 -148.23 0.48 Allowed 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 64.56 -80.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.421 0.288 . . . . 0.0 111.512 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . 172.38 -71.84 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.116 0.484 . . . . 0.0 111.153 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.649 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . 28.7 t0 -60.78 -35.06 75.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.106 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' B' ' 167' ' ' ASP . 4.1 tt0 71.44 -97.53 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.855 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 62.82 -170.26 0.18 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.767 0.318 . . . . 0.0 111.258 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' B' ' 156' ' ' ALA . 6.4 mtmm -137.93 -166.66 2.0 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.792 0.329 . . . . 0.0 111.534 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' B' ' 172' ' ' TRP . 12.0 p-10 -96.68 110.16 22.66 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.415 ' CE2' ' HB2' ' B' ' 154' ' ' GLU . 64.5 p-90 . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.228 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.882 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.44 0.673 0 C3'-C2'-C1' 105.923 2.302 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.569 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.732 0 OP1-P-O3' 111.013 1.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.569 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.41 1.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.652 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 107.136 -1.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.602 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 C4'-C3'-C2' 104.711 1.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.602 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C4'-C3'-C2' 104.338 1.138 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.555 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C3'-C2'-C1' 104.397 1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.52 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 N19-C1'-C2' 115.255 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.52 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 C3'-C2'-C1' 104.163 1.045 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.465 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.411 -0.671 0 C3'-C2'-C1' 105.354 1.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.465 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 N19-C1'-C2' 112.833 -0.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 106.907 0.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C1'-O4'-C4' 110.606 0.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.882 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.741 0 C4'-C3'-C2' 104.792 1.592 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.665 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O4'-C4'-C3' 106.189 0.589 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.661 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C4'-C3'-C2' 101.675 -1.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.661 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.759 0 O4'-C4'-C3' 104.503 -1.097 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.653 ' OP2' ' HA ' ' B' ' 107' ' ' VAL . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C4'-C3'-C2' 104.814 1.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.531 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C3'--C2' 1.526 0.802 0 C1'-O4'-C4' 107.235 -1.761 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.514 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C3'-C2'-C1' 104.308 1.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.514 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 C3'-C2'-C1' 104.992 1.637 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.482 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.738 0.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.478 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.944 0 C1'-O4'-C4' 107.035 -1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.42 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.427 1.234 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.406 ' C2 ' ' C2 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.923 0 C4'-C3'-C2' 104.213 1.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.47 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C1'-O4'-C4' 110.546 0.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 mmt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.397 0.141 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.665 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 1.5 mmtt 69.74 112.63 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 O-C-N 123.639 0.587 . . . . 0.0 110.918 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 108' ' ' THR . 13.5 tp60 -95.36 121.56 37.15 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.71 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.0 OUTLIER -77.68 102.95 7.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 121.499 0.666 . . . . 0.0 111.573 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.68 HG22 ' CD1' ' B' ' 114' ' ' TYR . 1.1 pt -100.79 111.57 30.88 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.548 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.54 120.48 38.87 Favored 'General case' 0 C--N 1.313 -1.02 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.846 -176.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.596 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.43 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.31 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.9 OUTLIER -68.06 79.94 0.22 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 -178.578 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.72 HG12 ' HB2' ' A' ' 14' ' ' TYR . 18.6 m -75.54 -145.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.701 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.66 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.94 -12.61 0.33 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.0 m -118.72 -62.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.09 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.856 ' HB2' ' CB ' ' B' ' 129' ' ' SER . 1.3 p30 -47.5 -91.84 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -175.87 41.19 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.423 -0.798 . . . . 0.0 111.342 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.78 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.2 OUTLIER -79.16 -41.8 27.63 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.564 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.59 -46.33 39.2 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -176.718 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.869 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -47.92 -33.88 8.26 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.598 0.713 . . . . 0.0 112.304 179.547 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -77.4 -60.48 2.35 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.705 179.577 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.564 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -59.41 -25.65 64.49 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.308 179.51 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.526 ' HB3' ' HB2' ' A' ' 67' ' ' ASP . . . -59.12 -31.32 68.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.232 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.785 ' CE2' HD21 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -93.78 -27.95 16.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.565 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 27.5 t70 121.46 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.133 0.973 . . . . 0.0 110.812 176.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.697 HG13 HD21 ' A' ' 17' ' ' LEU . 8.5 p -150.25 77.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.565 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.542 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -73.54 51.98 0.37 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 0.0 111.935 -179.898 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.713 ' HB ' HG22 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 40.75 -2.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 118.479 2.77 . . . . 0.0 118.479 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.5 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 3.9 p -38.19 -62.96 0.52 Allowed 'General case' 0 C--O 1.24 0.587 0 CA-C-N 119.479 1.036 . . . . 0.0 110.378 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.424 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -85.64 -34.41 13.73 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.988 177.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.593 HD13 HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -53.4 -61.34 2.36 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 120.825 0.345 . . . . 0.0 110.592 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.713 HG22 ' HB ' ' A' ' 24' ' ' ILE . 2.2 t -50.99 -68.24 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.473 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.607 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.4 m -50.09 -41.27 47.89 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 2.0 m -70.03 -51.63 30.6 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.12 -38.73 71.17 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.549 178.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.886 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.0 mtt -60.32 -56.17 24.68 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.82 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -48.85 -40.86 31.17 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.052 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -63.62 -57.06 11.27 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -10.09 59.21 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.093 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.0 -37.65 17.31 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -50.33 19.24 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.996 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.439 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -72.75 -17.98 61.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 113.948 -1.478 . . . . 0.0 111.876 -178.687 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.597 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.7 OUTLIER -13.98 120.71 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.513 1.125 . . . . 0.0 113.73 179.58 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.486 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -137.1 -66.16 0.52 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.612 ' HA ' ' CA ' ' B' ' 167' ' ' ASP . . . 92.1 120.07 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.984 0.514 . . . . 0.0 111.834 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.598 ' HB2' ' HB2' ' B' ' 169' ' ' ASN . 2.4 mt-10 -139.87 -71.52 0.38 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.577 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.572 ' HD3' ' O ' ' B' ' 171' ' ' ASP . 7.0 ptp180 176.52 107.01 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.701 0.286 . . . . 0.0 111.153 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.61 ' CD1' ' HB3' ' B' ' 168' ' ' GLU . 4.3 t90 -116.49 138.03 51.71 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 111.704 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 152.79 18.61 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.678 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.459 ' O ' ' CB ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -108.76 154.82 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.959 179.148 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.459 ' CB ' ' O ' ' A' ' 46' ' ' VAL . 3.6 tp10 90.88 152.82 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.306 0.643 . . . . 0.0 111.233 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -122.8 142.58 50.59 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.627 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.54 1.67 10.65 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -119.21 149.33 41.93 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.772 0.32 . . . . 0.0 111.03 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.51 44.25 0.88 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.724 -0.751 . . . . 0.0 113.328 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.42 ' O ' ' NH2' ' B' ' 137' ' ' ARG . 3.2 mmt -63.8 116.9 6.2 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.895 0.378 . . . . 0.0 110.882 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.7 t -130.3 43.3 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.69 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.402 ' HA ' ' CB ' ' A' ' 72' ' ' TRP . 0.7 OUTLIER -152.66 147.75 26.49 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 111.4 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.58 HG13 ' CE2' ' A' ' 72' ' ' TRP . 10.1 p -168.16 50.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.596 0.712 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.19 67.12 0.44 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.317 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -137.96 179.7 6.28 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.065 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -83.81 -75.99 0.31 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.913 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.8 pt 28.0 72.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.98 129.84 24.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.045 0.45 . . . . 0.0 110.976 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.464 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 1.4 mtp 173.45 -33.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.745 -179.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.466 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 1.1 t-20 77.09 -170.25 0.07 Allowed 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.133 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 64' ' ' SER . . . 106.02 59.52 0.62 Allowed Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.343 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 78.3 p 174.14 59.58 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.823 0.344 . . . . 0.0 110.493 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -166.08 52.76 0.09 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.929 0.395 . . . . 0.0 111.726 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.581 ' HB2' ' HB2' ' A' ' 20' ' ' TYR . . . -146.79 -59.74 0.29 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.027 0.441 . . . . 0.0 111.036 179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.764 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -87.02 -32.64 19.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.611 178.666 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -147.29 156.91 43.35 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.098 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -85.31 149.81 25.2 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 121.012 0.434 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.496 ' HA ' ' CZ2' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -73.3 56.2 0.47 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.683 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -104.64 105.42 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.233 0.539 . . . . 0.0 111.04 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.58 ' CE2' HG13 ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.775 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.468 ' CG ' ' H62' ' C' ' 173' ' ' ' DA' . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 CA-C-O 120.458 0.17 . . . . 0.0 111.429 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.552 ' HE2' " H3'" ' C' ' 175' ' ' ' DA' . 8.4 mttm -100.92 -171.25 1.97 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.567 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -105.97 100.34 9.9 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.459 0.647 . . . . 0.0 110.86 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.75 ' O ' " H3'" ' D' ' 191' ' ' ' DT' . 4.1 ttp180 -78.99 99.45 6.86 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.337 0.589 . . . . 0.0 110.632 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.682 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 21.8 pt -104.31 129.88 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.784 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 177.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.671 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.4 OUTLIER -131.35 125.83 33.68 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.428 -0.909 . . . . 0.0 112.84 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.666 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.8 98.29 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.71 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.1 p -66.87 95.79 0.39 Allowed 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.665 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 2.9 t -85.77 -128.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.915 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.582 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 24.0 t70 82.66 -12.56 0.89 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.923 0.783 . . . . 0.0 108.939 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -125.12 -61.44 1.29 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.01 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.607 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.9 OUTLIER -44.4 -94.4 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.577 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.41 ' N ' ' HB3' ' A' ' 29' ' ' SER . 34.2 t 179.42 41.75 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.871 0.759 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.879 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -83.51 -45.32 13.72 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.668 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.5 mt-30 -48.89 -39.27 25.31 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -174.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.533 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -58.29 -52.62 64.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.239 0.927 . . . . 0.0 111.752 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.886 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -49.07 -49.97 38.97 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.432 0.634 . . . . 0.0 111.422 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.668 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 2.1 pttt -76.01 -29.25 58.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.474 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.474 ' HB2' ' HA ' ' B' ' 116' ' ' LEU . . . -64.12 -28.18 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.083 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.597 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.72 -42.75 12.41 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 118.819 -0.61 . . . . 0.0 109.699 178.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 155.89 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 176.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.631 HG22 ' HB2' ' B' ' 164' ' ' SER . 76.0 t -154.19 91.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 121.816 -0.552 . . . . 0.0 111.777 -177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.469 ' O ' ' HE3' ' A' ' 32' ' ' MET . 0.0 OUTLIER -57.51 -88.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 178.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.704 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -154.72 -0.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 115.864 1.801 . . . . 0.0 115.864 179.039 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.565 ' HA ' HG21 ' A' ' 7' ' ' VAL . 22.0 p -39.46 -63.16 0.59 Allowed 'General case' 0 C--O 1.241 0.62 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.563 -179.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.82 -30.11 24.5 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 121.293 -0.48 . . . . 0.0 112.214 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.521 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 5.8 tp -58.59 -61.03 2.9 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.776 0.288 . . . . 0.0 110.33 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.704 HG21 ' HB ' ' B' ' 124' ' ' ILE . 2.5 t -51.37 -64.63 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.012 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.856 ' CB ' ' HB2' ' A' ' 12' ' ' ASP . 7.8 p -48.41 -45.0 35.53 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -46.63 51.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 25.4 m -60.64 -37.9 83.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.917 178.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.84 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.79 -58.4 8.74 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.978 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -58.79 -36.06 73.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.888 -178.875 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -74.07 -49.51 23.73 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.529 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.728 ' HG3' HD22 ' A' ' 17' ' ' LEU . 21.6 tp10 -69.95 -20.24 63.34 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.869 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.36 -52.78 5.01 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 13.8 mtt180 -57.28 -56.62 19.5 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 121.503 0.668 . . . . 0.0 110.2 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.472 ' HD2' ' CB ' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -72.57 -35.82 68.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.623 179.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.698 ' HA ' ' O ' ' B' ' 135' ' ' GLU . 0.2 OUTLIER 41.87 70.01 0.31 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.963 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.554 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 19.6 tpp180 119.71 78.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.152 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.472 ' CB ' ' HD2' ' B' ' 138' ' ' ARG . . . -157.44 160.09 37.98 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.683 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -69.05 0.77 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.534 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.27 128.86 20.27 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.765 0.317 . . . . 0.0 111.058 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 7.9 t-105 -162.42 151.4 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.246 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -128.97 -88.99 0.52 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 15.1 t 60.96 65.01 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.241 0.543 . . . . 0.0 111.435 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -93.04 -26.99 17.25 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.643 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 78.94 179.47 0.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.916 0.388 . . . . 0.0 111.41 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -105.6 116.19 31.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.84 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.98 -57.28 3.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.251 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -177.62 -138.82 3.14 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.768 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.44 161.36 17.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.692 0.282 . . . . 0.0 111.13 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.94 125.61 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.084 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -87.61 -63.23 1.34 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.434 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.534 ' HA ' ' CB ' ' B' ' 172' ' ' TRP . 46.2 t 77.18 92.53 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.01 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.23 135.73 9.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.992 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 153.84 29.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.1 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.443 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 1.7 t80 -140.9 162.46 35.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.363 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.443 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 5.3 mt 76.94 135.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.299 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.63 -27.81 18.81 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.535 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -52.95 57.09 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.684 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -177.45 -60.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . 0.539 ' HA3' ' CZ ' ' B' ' 165' ' ' PHE . . . 119.49 107.63 2.23 Favored Glycine 0 C--N 1.336 0.579 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.631 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.631 ' HB2' HG22 ' B' ' 122' ' ' VAL . 18.7 p -90.08 68.34 7.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.027 0.441 . . . . 0.0 111.551 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.539 ' CZ ' ' HA3' ' B' ' 163' ' ' GLY . 0.2 OUTLIER -123.04 62.84 1.0 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.089 0.471 . . . . 0.0 110.762 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.449 ' HB3' ' HB2' ' B' ' 121' ' ' ASP . . . -136.42 44.36 2.41 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.153 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.612 ' CA ' ' HA ' ' A' ' 41' ' ' ALA . 23.0 t0 -171.82 -74.83 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.905 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.61 ' HB3' ' CD1' ' A' ' 44' ' ' TRP . 0.3 OUTLIER -56.82 156.77 6.19 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.102 0.477 . . . . 0.0 111.595 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.598 ' HB2' ' HB2' ' A' ' 42' ' ' GLU . 55.9 t-20 -135.52 143.5 45.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.195 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 6.2 tptp -169.71 -46.06 0.02 OUTLIER 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.736 ' HB3' ' CE3' ' B' ' 172' ' ' TRP . 0.3 OUTLIER -158.01 -90.26 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.736 ' CE3' ' HB3' ' B' ' 171' ' ' ASP . 44.6 p90 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.241 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.873 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 105.751 2.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.735 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.784 0 C3'-C2'-C1' 106.319 2.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.722 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.522 0 O4'-C1'-C2' 107.161 0.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.413 ' H73' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C4'-C3' 106.413 0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.64 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C4'-C3'-C2' 104.652 1.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.64 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C4'-C3'-C2' 104.648 1.448 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.644 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 104.621 1.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.485 H2'' ' C8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 O4'-C1'-C2' 104.842 -1.144 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.809 " H3'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C3'-C2'-C1' 104.566 1.333 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.711 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.765 0 C3'-C2'-C1' 105.442 1.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.711 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 O4'-C1'-C2' 107.126 0.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.584 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 N19-C1'-C2' 115.338 0.711 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 O4'-C1'-C2' 106.974 0.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.885 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-C2' 107.382 1.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.769 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C4'-C3'-C2' 102.387 -0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.769 ' H8 ' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 O4'-C4'-C3' 106.164 0.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.49 ' OP1' ' HG3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 O4'-C1'-C2' 106.645 0.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.5 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.008 0 C1'-O4'-C4' 107.088 -1.866 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.75 " H3'" ' O ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.226 1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.643 " O5'" ' H8 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C3'-C2'-C1' 106.008 2.363 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.528 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 104.289 1.135 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.42 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-C2' 107.261 1.056 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C1'-O4'-C4' 107.117 -1.845 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.631 0 C1'-O4'-C4' 110.757 0.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 104.011 0.811 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 102.063 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.522 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 1' ' ' MET . 5.9 mmtm 74.22 120.24 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.931 0.492 . . . . 0.0 110.872 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.66 ' HB3' HG23 ' B' ' 109' ' ' VAL . 1.7 tt0 -109.83 108.82 19.27 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.028 0.442 . . . . 0.0 110.235 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.816 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.1 ttm105 -79.63 110.15 14.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.969 . . . . 0.0 112.239 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.722 HG23 ' CD2' ' B' ' 114' ' ' TYR . 0.4 OUTLIER -104.82 130.95 55.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 176.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.704 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -131.48 130.02 41.9 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.435 -1.306 . . . . 0.0 113.523 -177.213 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.51 98.21 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.619 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.503 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 1.2 p -71.08 67.42 0.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.581 0.705 . . . . 0.0 109.529 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.658 HG11 ' CB ' ' A' ' 14' ' ' TYR . 7.1 p -88.83 -131.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-O 117.433 -1.27 . . . . 0.0 109.961 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.691 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 32.3 t70 114.43 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 119.759 1.163 . . . . 0.0 110.975 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 63.1 p 173.64 -27.29 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.524 -1.217 . . . . 0.0 113.379 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.718 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 33.0 m-20 -80.89 70.06 7.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.249 -0.981 . . . . 0.0 112.118 -177.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.548 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 34.5 m 57.46 -11.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 178.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.806 ' CE1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -56.84 -53.77 54.07 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.113 0.87 . . . . 0.0 109.868 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.7 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.2 mt-30 -49.35 -42.24 41.25 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.476 -178.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -56.06 20.5 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.371 0.532 . . . . 0.0 111.843 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.777 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.06 -47.55 33.82 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.121 -179.18 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.725 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 22.8 pttt -79.42 -30.5 42.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.178 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -26.39 68.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.862 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.551 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.02 -43.94 11.35 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 118.636 -0.697 . . . . 0.0 109.481 178.418 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.522 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 154.49 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 176.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.447 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 74.4 t -157.93 90.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 CA-C-O 120.785 0.326 . . . . 0.0 110.642 -178.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.725 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -57.22 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.404 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.7 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -150.08 -2.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 179.866 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.623 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 55.6 p -39.61 -65.01 0.42 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.896 -177.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.66 -24.33 50.33 Favored Glycine 0 C--O 1.228 -0.25 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.603 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.569 HD11 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.24 -62.27 1.72 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 122.482 0.313 . . . . 0.0 111.324 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.7 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.5 t -53.18 -62.74 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 O-C-N 123.02 0.2 . . . . 0.0 110.815 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.768 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 12.9 p -48.35 -40.04 24.15 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.553 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -75.7 -45.82 34.68 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.416 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.505 ' OG1' ' HA ' ' A' ' 28' ' ' VAL . 1.9 p -57.84 -45.01 86.86 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 178.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.856 ' SD ' HD12 ' B' ' 117' ' ' LEU . 4.0 mmt -57.5 -57.19 13.77 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.151 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.414 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -57.91 -39.83 78.89 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -63.65 -57.27 10.59 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.843 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.97 -14.49 62.38 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.825 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.798 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.22 -28.85 22.13 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 120.998 0.428 . . . . 0.0 110.822 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -49.84 10.9 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.974 0.893 . . . . 0.0 109.277 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.22 -42.28 31.8 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 113.884 -1.507 . . . . 0.0 112.554 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.55 ' CD2' ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 32.1 52.25 0.24 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.385 0.674 . . . . 0.0 112.483 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 1.5 mmt180 178.54 35.24 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.99 0.424 . . . . 0.0 111.733 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -118.14 42.0 2.79 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.906 0.384 . . . . 0.0 111.257 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.466 ' HG2' ' HD3' ' A' ' 43' ' ' ARG . 6.1 pm0 -66.04 57.92 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.229 0.538 . . . . 0.0 111.697 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.466 ' HD3' ' HG2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 176.99 117.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.732 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.2 -83.36 0.13 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.138 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.715 ' HA ' ' HE2' ' B' ' 145' ' ' LYS . 9.7 ptpt -163.08 159.85 23.69 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.985 0.422 . . . . 0.0 111.926 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.4 m -132.68 54.46 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.281 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.94 81.37 0.21 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.685 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -106.39 -168.87 1.48 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.354 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -84.36 -58.54 2.71 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 72.08 116.62 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.144 0.497 . . . . 0.0 111.493 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -179.13 156.33 18.26 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.86 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.9 mtt 64.23 29.53 13.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.68 0.276 . . . . 0.0 111.56 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m -125.37 76.77 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 120.953 0.406 . . . . 0.0 111.071 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 53' ' ' VAL . 1.7 mp0 67.48 -71.17 0.11 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.228 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.541 ' HA ' ' CD1' ' A' ' 72' ' ' TRP . 3.1 t 45.37 45.41 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 112.018 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -47.2 -57.74 4.83 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.747 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.541 ' O ' ' CB ' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -143.93 161.19 39.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.191 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 57' ' ' ARG . 76.3 t80 147.55 -52.31 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.935 0.494 . . . . 0.0 111.332 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 pt -67.59 67.57 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -148.24 159.01 44.41 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.152 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 75.6 mtp -79.49 72.6 6.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.903 0.382 . . . . 0.0 111.267 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.45 129.15 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.231 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.511 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -92.02 160.79 26.36 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.938 -0.648 . . . . 0.0 113.042 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.511 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 3.8 m 73.86 145.52 0.08 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.121 0.486 . . . . 0.0 111.857 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -156.25 146.7 21.64 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.637 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -171.85 -120.78 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.072 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.16 131.97 55.22 Favored 'General case' 0 C--N 1.331 -0.231 0 O-C-N 122.274 -0.266 . . . . 0.0 110.549 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -150.35 -69.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 6.2 p-10 -117.57 -73.91 0.63 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.711 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER 158.29 -39.68 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.123 0.569 . . . . 0.0 111.467 179.016 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.402 ' HB3' ' CD1' ' A' ' 72' ' ' TRP . 71.0 m-20 63.6 -80.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.535 0.522 . . . . 0.0 111.693 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.541 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 3.8 p-90 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.91 -0.567 . . . . 0.0 110.678 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 119.71 -0.185 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.01 119.28 28.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.202 0.525 . . . . 0.0 111.613 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.691 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.8 OUTLIER -111.04 108.29 17.97 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.526 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.677 ' NH1' ' H62' ' C' ' 179' ' ' ' DA' . 5.0 ttp180 -77.44 104.67 8.1 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.474 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.806 HG13 ' CE1' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -95.61 109.17 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.668 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.705 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -117.95 116.94 27.94 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 118.759 -1.176 . . . . 0.0 113.158 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.634 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -100.73 103.18 14.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.816 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 17.9 p -70.33 87.3 0.61 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.777 0.799 . . . . 0.0 110.249 -178.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.794 HG21 ' CD1' ' B' ' 114' ' ' TYR . 19.7 m -72.78 -137.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.912 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.527 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.9 t0 92.3 -8.43 0.2 Allowed 'General case' 0 C--N 1.356 0.864 0 CA-C-O 121.458 0.646 . . . . 0.0 109.603 -177.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 6.1 t -136.47 -55.24 0.74 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.489 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.768 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -44.04 -94.25 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -177.625 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 32' ' ' MET . 0.1 OUTLIER 176.48 37.56 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.963 0.802 . . . . 0.0 110.939 -179.508 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.794 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.22 -43.97 15.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -179.293 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.713 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.2 mm100 -47.55 -37.46 12.3 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -174.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.798 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -64.32 -56.96 10.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.053 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.856 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -52.33 -41.42 62.98 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.255 -177.142 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.713 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.3 OUTLIER -79.38 -29.37 42.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.627 -179.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.535 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -64.38 -30.63 71.67 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.39 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.632 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.95 -40.47 13.02 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.499 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.632 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 22.2 t70 170.2 15.01 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.682 ' CG1' ' HB2' ' B' ' 127' ' ' LEU . 51.4 t -135.45 76.15 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 121.333 -0.854 . . . . 0.0 113.101 -177.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.655 ' HA ' ' CB ' ' B' ' 118' ' ' LYS . 1.8 m120 -66.06 57.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.657 HG22 ' CE ' ' A' ' 32' ' ' MET . 0.2 OUTLIER 50.99 -26.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.738 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.96 -64.22 0.42 Allowed 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.395 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.57 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.37 -20.77 53.92 Favored Glycine 0 C--O 1.227 -0.332 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.415 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.682 ' HB2' ' CG1' ' B' ' 122' ' ' VAL . 0.3 OUTLIER -59.39 -60.35 4.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.684 ' O ' ' HG2' ' B' ' 132' ' ' MET . 74.8 t -54.1 -65.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.719 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.718 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 52.5 p -49.17 -46.95 46.14 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.57 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -75.41 -50.33 16.21 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 119.376 0.989 . . . . 0.0 110.358 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.12 -44.14 74.73 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.435 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.777 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 5.7 mmt -52.35 -45.66 65.78 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.203 178.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.548 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -52.93 -48.0 67.63 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.904 0.383 . . . . 0.0 111.535 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.7 -51.59 67.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 1.3 mm-40 -77.4 -9.29 58.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.977 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -88.05 -33.97 18.13 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -55.67 5.45 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 121.782 0.801 . . . . 0.0 109.354 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.526 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 4.6 mmp_? -84.56 -38.07 20.43 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.457 -178.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.551 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 43.97 60.79 2.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.033 0.533 . . . . 0.0 111.354 -177.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.85 5.29 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 74.69 81.08 0.11 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.798 0.439 . . . . 0.0 111.713 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.436 ' HG3' ' HG3' ' B' ' 138' ' ' ARG . 1.9 mm-40 -90.64 155.0 19.17 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.3 mtm105 177.98 -174.03 0.14 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.615 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 124.07 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.715 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 177.96 -69.8 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.841 178.363 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 19.5 t 48.02 55.23 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 121.596 0.712 . . . . 0.0 110.168 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.469 ' HB2' ' HD3' ' B' ' 145' ' ' LYS . 3.7 tt0 -108.42 -152.72 0.49 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.576 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -144.24 126.46 15.65 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.834 0.349 . . . . 0.0 110.788 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -166.61 130.54 2.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.947 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.22 -61.26 1.41 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 130.48 101.52 0.92 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.518 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpt -109.19 -19.88 13.17 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.64 -73.21 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.79 138.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.624 0.578 . . . . 0.0 111.852 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.8 t -147.39 46.82 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.128 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.87 112.93 17.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -51.29 2.88 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.251 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -110.99 76.81 1.0 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.632 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 8.7 pt 44.11 39.15 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -83.65 79.6 9.39 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.347 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -166.49 -39.26 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.4 t30 70.27 -171.91 0.17 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.674 0.273 . . . . 0.0 110.943 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -128.24 92.58 0.35 Allowed Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.785 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.667 ' HB3' ' HB3' ' B' ' 168' ' ' GLU . 2.5 p -100.48 142.67 31.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.795 0.331 . . . . 0.0 111.657 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -100.16 -49.38 4.3 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -109.6 -56.17 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.03 0.443 . . . . 0.0 111.121 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' B' ' 164' ' ' SER . 5.1 m-20 -133.39 -99.42 0.27 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.944 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.667 ' HB3' ' HB3' ' B' ' 164' ' ' SER . 0.8 OUTLIER 61.71 -69.4 0.05 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.472 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 167' ' ' ASP . 0.0 OUTLIER -166.39 156.69 12.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.703 0.287 . . . . 0.0 110.851 -179.736 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.504 ' HD2' ' HA ' ' B' ' 170' ' ' LYS . 3.0 tptp -102.07 176.59 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.245 0.545 . . . . 0.0 112.077 -178.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' B' ' 172' ' ' TRP . 0.7 OUTLIER -69.9 100.33 1.55 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.641 -179.532 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.472 ' HB3' ' O ' ' B' ' 171' ' ' ASP . 22.7 t90 . . . . . 0 C--O 1.252 1.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.629 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.873 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.44 0.694 0 O4'-C1'-C2' 107.163 0.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.857 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.639 0 P-O3'-C3' 120.82 0.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.588 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.574 0 C1'-O4'-C4' 110.653 0.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.418 ' C4 ' ' C5 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.889 0 C4'-C3'-C2' 104.761 1.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.685 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.89 0 C4'-C3'-C2' 104.71 1.51 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.685 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.781 0 C4'-C3'-C2' 104.559 1.359 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.677 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 O4'-C1'-C2' 107.087 0.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.488 H2'' ' C8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C4'-C3'-C2' 104.442 1.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.488 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 O4'-C1'-C2' 106.9 0.727 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.472 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.732 0 C3'-C2'-C1' 105.534 2.024 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.58 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-C2' 107.054 0.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.58 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 105.158 -0.856 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C1'-O4'-C4' 110.264 0.403 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.878 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.58 0 O4'-C1'-C2' 107.031 0.847 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.805 " H3'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C4'-C3'-C2' 102.606 -0.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.476 H2'' ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 106.844 0.676 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.703 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C4'-C3'-C2' 102.289 -0.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.703 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.963 0 C3'-C2'-C1' 104.827 1.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.507 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-C2' 107.374 1.159 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.482 ' N6 ' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.855 1.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.506 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.41 -0.788 0 C3'-C2'-C1' 105.384 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.49 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.557 0 C3'-C2'-C1' 104.324 1.16 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.46 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 C1'-O4'-C4' 107.372 -1.663 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.41 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C1'-O4'-C4' 111.101 1.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.819 0 C4'-C3'-C2' 104.592 1.392 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 O4'-C1'-C2' 107.255 1.05 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 120.225 0.059 . . . . 0.0 111.124 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.34 144.58 17.21 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.658 0.266 . . . . 0.0 110.945 179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.749 ' HB3' ' CB ' ' B' ' 110' ' ' ASP . 1.4 tp60 -114.55 129.11 56.64 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.762 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.758 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 15.1 ttp85 -78.31 99.41 6.31 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.714 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.784 HG23 ' CG ' ' B' ' 114' ' ' TYR . 1.3 pt -94.61 113.86 30.01 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.236 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.713 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.812 ' OG1' ' H73' ' C' ' 178' ' ' ' DT' . 0.6 OUTLIER -119.6 122.69 42.14 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.092 -1.043 . . . . 0.0 112.581 -178.013 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.633 ' CG1' ' CG2' ' B' ' 105' ' ' ILE . 2.1 p -99.23 106.75 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 114.242 -1.345 . . . . 0.0 107.936 177.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.798 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.7 OUTLIER -70.1 68.09 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.098 0.951 . . . . 0.0 108.6 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.729 ' CG2' ' HB3' ' A' ' 14' ' ' TYR . 9.8 p -72.54 -142.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.581 -1.645 . . . . 0.0 112.895 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.662 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 7.1 t70 86.61 -5.3 0.72 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.763 0.792 . . . . 0.0 109.311 -176.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.46 -73.03 0.66 Allowed 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.341 177.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.728 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.0 m-20 -32.94 -77.26 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.789 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.484 ' N ' ' HB2' ' B' ' 129' ' ' SER . 1.8 m 167.22 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.188 0.518 . . . . 0.0 111.106 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.89 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -84.6 -47.14 10.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 179.728 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.563 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.9 mt-30 -48.91 -38.94 24.23 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -174.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.499 ' HG ' ' CG ' ' B' ' 150' ' ' GLU . 0.8 OUTLIER -52.07 -57.61 9.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.485 1.038 . . . . 0.0 111.574 179.17 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.701 ' HG ' ' HA ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -55.4 -44.25 76.01 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.648 -177.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.6 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -76.28 -25.65 55.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.065 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -29.27 53.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.732 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.653 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.4 m-30 -87.71 -46.24 9.67 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 177.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 138.51 34.94 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.874 1.359 . . . . 0.0 111.223 177.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.511 ' O ' HD13 ' A' ' 17' ' ' LEU . 16.4 t -116.01 76.59 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.014 0.435 . . . . 0.0 111.875 -178.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' ' CD1' ' A' ' 24' ' ' ILE . 16.2 p30 -67.84 44.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.763 HG12 ' HE1' ' B' ' 132' ' ' MET . 0.7 OUTLIER 39.52 1.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 178.044 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' ASN . 6.9 p -38.57 -63.59 0.5 Allowed 'General case' 0 C--O 1.244 0.802 0 CA-C-N 119.048 0.84 . . . . 0.0 110.904 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.422 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -86.22 -21.37 52.36 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.613 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.616 HD11 HD11 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -71.2 -62.54 1.36 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.896 0.348 . . . . 0.0 111.223 -179.376 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.646 HG23 HG21 ' B' ' 128' ' ' VAL . 2.1 t -51.05 -62.23 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.648 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 17.8 p -48.83 -31.12 6.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 122.651 0.38 . . . . 0.0 111.842 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -77.06 -57.92 3.57 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.401 HG21 HD21 ' B' ' 127' ' ' LEU . 9.0 m -52.96 -44.64 67.26 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.158 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.779 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 3.4 mmt -49.34 -43.55 43.86 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.411 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.55 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -63.61 -48.77 75.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.106 0.412 . . . . 0.0 110.44 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.49 ' O ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -60.82 -53.34 58.51 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HB3' ' CD1' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -61.6 -41.8 97.95 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.269 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.768 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -58.46 -44.44 89.26 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.352 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.401 ' NH2' ' OE1' ' A' ' 33' ' ' GLN . 4.6 mtt-85 -69.5 -54.53 13.76 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 34' ' ' ASN . 3.8 mmp_? -57.41 -36.68 71.64 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.232 -178.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.579 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 8.39 85.18 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.195 0.998 . . . . 0.0 113.209 179.793 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.54 124.44 14.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.354 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.34 -70.44 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -178.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -158.2 77.76 0.8 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.881 0.372 . . . . 0.0 111.968 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.439 ' O ' ' HB3' ' A' ' 44' ' ' TRP . 4.1 ttt85 67.63 141.94 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.085 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.439 ' HB3' ' O ' ' A' ' 43' ' ' ARG . 52.4 t90 76.41 134.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.684 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.32 77.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.428 ' CG1' ' H ' ' A' ' 47' ' ' GLU . 1.5 p -157.27 -91.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.781 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' H ' ' CG1' ' A' ' 46' ' ' VAL . 0.8 OUTLIER 66.21 -62.28 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.752 0.251 . . . . 0.0 111.345 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -117.57 -176.18 2.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.884 0.373 . . . . 0.0 111.394 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.2 139.01 31.15 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.485 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -130.1 128.86 42.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.62 -104.79 0.26 Allowed Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.806 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.52 57.04 2.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.152 0.501 . . . . 0.0 111.495 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 53.0 t -141.9 109.42 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.846 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -127.53 132.91 49.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.964 0.412 . . . . 0.0 111.326 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.476 ' HB ' ' NE1' ' A' ' 72' ' ' TRP . 2.6 t -127.89 56.58 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.181 0.515 . . . . 0.0 110.843 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -132.22 149.03 52.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.4 ' HG3' ' N ' ' A' ' 58' ' ' PHE . 0.5 OUTLIER -81.53 -28.22 34.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.799 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.458 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 0.7 OUTLIER -173.82 -76.66 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.085 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.458 ' HB ' ' O ' ' A' ' 58' ' ' PHE . 17.9 tt 169.82 148.84 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.566 0.346 . . . . 0.0 111.191 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.62 -160.99 1.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.892 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.402 ' O ' ' N ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -124.26 -92.22 0.53 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.874 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.3 t30 64.49 -55.51 0.27 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.796 0.438 . . . . 0.0 112.168 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 61' ' ' MET . . . 78.86 -56.45 4.27 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.47 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.6 m 67.21 -60.29 0.37 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.401 0.28 . . . . 0.0 111.547 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 62.29 48.6 4.7 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -175.55 -105.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.879 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.442 ' CB ' HD13 ' B' ' 139' ' ' LEU . 4.3 p-10 -83.13 48.55 1.39 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.506 0.67 . . . . 0.0 110.561 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 179.23 149.36 0.26 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.821 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 9.7 t-20 -174.08 110.02 0.15 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.502 ' HD3' ' N ' ' A' ' 71' ' ' ASP . 8.7 tmtt? 75.44 152.71 0.13 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.086 0.469 . . . . 0.0 111.874 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.502 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 3.1 t70 -68.11 -160.14 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.556 179.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.476 ' NE1' ' HB ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.015 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.3 tmm? . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 120.655 0.264 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 15.4 mmtt -138.57 173.0 12.05 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.4 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.662 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 11.5 tp60 -125.97 124.64 41.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.083 0.468 . . . . 0.0 111.231 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.444 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.31 112.24 16.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.032 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.89 HG13 ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -107.16 128.94 61.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.182 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.175 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.743 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -131.47 120.18 22.63 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.696 -179.804 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.603 HG11 HD12 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -103.5 93.69 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 174.342 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.758 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 41.8 p -70.52 89.31 0.7 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.045 -1.034 . . . . 0.0 109.687 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.651 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 21.6 m -141.35 -0.98 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.749 ' CB ' ' HB3' ' A' ' 3' ' ' GLN . 0.0 OUTLIER 17.85 -74.65 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.645 1.111 . . . . 0.0 112.209 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.62 ' N ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -66.7 -20.16 65.91 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -179.143 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.651 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 1.2 t0 -78.72 62.8 3.33 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 120.017 1.28 . . . . 0.0 111.132 -178.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.55 ' HB3' ' CA ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER 58.91 -24.87 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 179.507 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.784 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.02 -56.52 3.29 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-O 121.708 0.766 . . . . 0.0 110.424 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' B' ' 110' ' ' ASP . 20.3 pt20 -49.54 -39.93 36.37 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.713 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.768 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -60.61 -43.84 97.0 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.664 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.779 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.45 -50.03 74.43 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.457 0.646 . . . . 0.0 111.439 -179.314 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.673 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.8 pttt -70.13 -25.88 63.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.581 178.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.443 ' HB2' ' O ' ' B' ' 116' ' ' LEU . . . -60.38 -26.67 66.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.54 177.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.682 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.7 OUTLIER -88.41 -44.94 10.38 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.372 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 150.13 63.0 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 176.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.661 ' CG1' HD21 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -157.6 -42.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.673 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER 58.18 59.26 3.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.465 0.65 . . . . 0.0 110.014 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.763 ' CG1' ' HE2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 40.53 -11.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 118.478 2.77 . . . . 0.0 118.478 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.559 ' HA ' ' CG2' ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.03 -56.43 1.15 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.112 -177.888 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.76 -24.63 52.66 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.533 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.665 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 1.0 OUTLIER -70.32 -61.48 1.76 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.971 0.509 . . . . 0.0 111.142 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.646 HG21 HG23 ' A' ' 28' ' ' VAL . 71.0 t -46.42 -54.4 2.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.728 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.05 -40.73 86.01 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 90.6 m -74.05 -49.84 22.36 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.513 HG22 ' HA ' ' B' ' 128' ' ' VAL . 3.4 t -55.34 -30.86 61.08 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.674 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.763 ' HE1' HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.69 -57.61 11.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.779 179.023 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -46.03 85.07 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -179.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -64.54 -50.59 66.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.812 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.596 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -71.84 -25.04 61.81 Favored 'General case' 0 C--O 1.217 -0.642 0 C-N-CA 120.349 -0.54 . . . . 0.0 110.069 178.267 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -71.56 -46.33 59.72 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 177.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -60.17 -56.02 26.66 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.505 0.669 . . . . 0.0 110.126 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.471 ' HD2' ' O ' ' B' ' 139' ' ' LEU . 4.6 tmm_? -77.81 -49.35 14.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.866 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' B' ' 135' ' ' GLU . 0.3 OUTLIER 37.27 -146.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.525 0.73 . . . . 0.0 111.924 -178.46 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.416 ' H ' ' HB3' ' B' ' 139' ' ' LEU . 21.0 tpp85 -146.49 -84.63 0.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.778 -0.576 . . . . 0.0 111.942 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -179.51 97.08 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.652 0.263 . . . . 0.0 111.333 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -112.92 -45.2 3.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.058 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 77.49 169.88 0.22 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.177 0.513 . . . . 0.0 111.949 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 72.59 65.71 0.12 Allowed 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.35 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' A' ' 20' ' ' TYR . 2.0 mmtm -134.54 95.14 3.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.159 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.82 52.41 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.251 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.22 -50.2 1.79 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.539 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . 0.403 ' O ' ' CB ' ' B' ' 149' ' ' GLN . 24.0 m120 68.41 177.64 0.25 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.995 0.426 . . . . 0.0 111.975 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' B' ' 148' ' ' ASN . 0.6 OUTLIER 85.0 105.52 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.0 179.744 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . 0.499 ' CG ' ' HG ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -119.76 149.84 41.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.718 179.297 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -72.54 61.19 1.56 Allowed Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.495 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.88 66.42 5.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.155 0.502 . . . . 0.0 110.962 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 13.7 p -164.71 134.92 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.804 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.525 ' HB3' ' CH2' ' B' ' 172' ' ' TRP . 2.4 pp20? -143.46 169.15 18.22 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.851 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.648 HG13 ' HB3' ' B' ' 172' ' ' TRP . 12.3 p -150.69 38.35 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.304 0.573 . . . . 0.0 111.937 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.489 ' C ' ' HG2' ' B' ' 157' ' ' ARG . . . -82.73 99.78 9.85 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.128 -0.357 . . . . 0.0 110.77 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . 0.489 ' HG2' ' C ' ' B' ' 156' ' ' ALA . 39.8 mmt-85 -154.27 135.62 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.565 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.407 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 48.9 m-85 66.08 -53.44 0.4 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 178.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.407 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 17.1 mt 83.38 156.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.745 0.418 . . . . 0.0 111.224 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.71 -51.67 9.49 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.82 -179.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -159.58 -44.11 0.05 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 13.8 m-80 -57.06 133.04 54.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.94 0.4 . . . . 0.0 111.584 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -104.85 142.18 15.44 Favored Glycine 0 C--N 1.334 0.425 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.865 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.505 ' CB ' ' HG3' ' B' ' 168' ' ' GLU . 0.2 OUTLIER -71.71 64.89 0.48 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.049 0.452 . . . . 0.0 111.552 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -94.81 -1.54 52.6 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.759 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -145.53 105.57 4.03 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.395 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.524 ' O ' ' CB ' ' B' ' 168' ' ' GLU . 19.3 t70 71.49 -56.93 0.62 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.752 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.524 ' CB ' ' O ' ' B' ' 167' ' ' ASP . 32.5 tt0 104.7 100.31 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.191 0.997 . . . . 0.0 110.853 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.83 176.35 9.65 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.268 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 51.93 1.66 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.21 127.43 31.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.648 ' HB3' HG13 ' B' ' 155' ' ' VAL . 47.6 m0 . . . . . 0 C--O 1.253 1.287 0 CA-C-O 118.568 -0.73 . . . . 0.0 110.925 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.877 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O4'-C1'-C2' 106.759 0.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.59 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C3'-C2'-C1' 101.219 -1.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.498 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.539 0 O4'-C1'-C2' 107.329 1.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.798 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.953 0 C4'-C3'-C2' 104.66 1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.714 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 C4'-C3'-C2' 104.866 1.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.812 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 C4'-C3'-C2' 104.761 1.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.625 ' H62' ' NH2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.492 0 C3'-C2'-C1' 105.469 1.978 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.593 " O5'" H2'' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 N19-C1'-C2' 115.401 0.75 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.569 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.442 1.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.49 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C3'-C2'-C1' 104.799 1.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.49 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.512 -0.676 0 C4'-C3'-C2' 104.082 0.882 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.441 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O4'-C1'-C2' 106.803 0.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 N19-C1'-C2' 115.061 0.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.877 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-C2' 105.339 -0.692 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.405 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 106.939 0.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.405 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C1'-O4'-C4' 110.422 0.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 O4'-C4'-C3' 106.143 0.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.511 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 104.262 1.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.605 ' H71' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.895 0 N19-C1'-C2' 115.54 0.838 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.548 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 104.787 1.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.597 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.732 0 C3'-C2'-C1' 105.839 2.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.597 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C3'-C2'-C1' 104.601 1.358 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.411 ' C4 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.87 0 C1'-O4'-C4' 107.145 -1.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 104.273 1.073 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.791 0 C4'-C3'-C2' 104.252 1.052 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.498 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C4'-C3' 106.129 0.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -81.54 -173.06 4.17 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.035 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.85 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -122.77 110.02 14.94 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.651 0.739 . . . . 0.0 111.528 -179.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.795 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.2 ttm105 -83.64 113.96 21.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.246 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.667 HD13 ' CG1' ' B' ' 107' ' ' VAL . 0.1 OUTLIER -104.51 130.6 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.763 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -126.79 126.01 42.68 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.806 -0.758 . . . . 0.0 112.735 -177.469 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.627 ' CG1' ' CG2' ' B' ' 105' ' ' ILE . 0.6 OUTLIER -100.51 109.09 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.627 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.561 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 15.2 p -70.67 68.31 0.39 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.683 0.754 . . . . 0.0 109.333 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.726 HG22 ' HB3' ' A' ' 14' ' ' TYR . 8.3 p -76.23 -143.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.253 -1.34 . . . . 0.0 111.795 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.707 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 7.2 t70 87.43 1.56 0.44 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-O 122.067 0.937 . . . . 0.0 109.86 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.5 m -129.24 -64.72 0.89 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.18 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.763 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 1.2 m-20 -42.37 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.998 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m 178.54 41.61 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.607 0.639 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.894 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.5 OUTLIER -82.83 -49.48 9.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -179.166 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.66 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.1 mm-40 -48.15 -36.55 13.69 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -173.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HB3' ' HB3' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.8 -53.29 59.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.86 0.754 . . . . 0.0 112.183 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.871 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.97 -45.76 51.78 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.236 0.541 . . . . 0.0 111.553 -178.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -77.73 -25.73 49.48 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.852 178.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -28.65 69.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.621 178.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.67 ' CE1' ' HB ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -88.12 -41.93 12.7 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.587 178.386 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 154.23 14.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 176.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.67 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 70.3 t -152.66 92.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 121.794 -0.566 . . . . 0.0 112.086 -177.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.533 ' HB2' HD11 ' A' ' 24' ' ' ILE . 4.8 p30 -58.41 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.762 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.29 -2.67 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 115.599 1.704 . . . . 0.0 115.599 178.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -39.29 -64.37 0.47 Allowed 'General case' 0 C--O 1.245 0.82 0 C-N-CA 119.922 -0.711 . . . . 0.0 109.346 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.62 -28.67 26.2 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.058 -0.591 . . . . 0.0 111.964 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.597 ' CB ' ' HA ' ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.71 -61.12 2.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.597 0.359 . . . . 0.0 110.752 179.238 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.762 HG23 ' HB ' ' A' ' 24' ' ' ILE . 2.4 t -51.98 -63.72 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.693 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 5.4 p -49.15 -39.05 27.41 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.5 m -71.88 -58.42 3.48 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.46 HG23 ' OG1' ' B' ' 131' ' ' THR . 19.2 m -53.92 -42.84 69.22 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.01 179.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.794 ' SD ' HD13 ' B' ' 117' ' ' LEU . 11.4 mmt -56.61 -57.3 12.98 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.855 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -38.84 65.34 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -53.5 24.97 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.349 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.603 ' HB3' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -67.84 -25.94 65.8 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.248 178.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.534 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.93 -43.7 64.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -50.62 72.83 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.939 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.9 OUTLIER -56.79 -57.21 13.44 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.221 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.608 HD13 ' HB3' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 11.09 -82.97 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.32 1.048 . . . . 0.0 113.377 179.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 1.9 tpt180 63.91 4.04 1.84 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.52 53.32 0.21 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.802 -0.561 . . . . 0.0 111.626 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.452 ' O ' ' HD2' ' A' ' 43' ' ' ARG . 10.1 pt-20 -83.17 8.4 13.28 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.098 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.452 ' HD2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -137.04 177.77 7.6 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.024 0.44 . . . . 0.0 111.317 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -82.2 168.16 17.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.172 0.51 . . . . 0.0 112.002 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.89 127.19 30.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.498 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 33.2 t -83.29 -71.21 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -171.5 171.01 5.59 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.947 0.403 . . . . 0.0 111.428 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.26 114.28 1.42 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.71 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.15 136.92 53.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.192 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.432 ' HA ' ' CE1' ' B' ' 158' ' ' PHE . 17.9 tt0 70.87 135.31 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.205 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -178.75 115.35 0.49 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.568 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.4 mtt -146.53 54.41 1.12 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.351 0.596 . . . . 0.0 110.066 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.497 ' HB ' ' HG2' ' B' ' 154' ' ' GLU . 9.9 p -93.59 -19.99 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.284 -179.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 pp20? -57.41 154.39 10.94 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.082 0.468 . . . . 0.0 111.6 -179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 m -129.23 43.51 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.701 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.515 ' O ' ' HB2' ' A' ' 57' ' ' ARG . . . -103.66 152.81 21.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.848 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER 78.24 165.43 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.626 0.37 . . . . 0.0 110.706 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 67.63 -57.36 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.765 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.0 tt -92.17 -66.32 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 43.96 66.58 0.81 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.504 0.669 . . . . 0.0 111.511 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.426 ' O ' ' NE ' ' B' ' 143' ' ' ARG . 4.7 tpt -77.71 -58.76 3.09 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.55 -0.75 . . . . 0.0 112.324 -179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.77 166.42 21.78 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.402 ' O ' ' HA ' ' B' ' 142' ' ' GLU . . . 175.35 131.39 1.43 Allowed Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.883 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 m -121.48 131.29 54.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 117.029 0.415 . . . . 0.0 111.559 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 50.9 -165.03 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.887 0.375 . . . . 0.0 111.347 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.602 ' HA ' ' HA ' ' B' ' 139' ' ' LEU . . . -81.38 -59.41 2.64 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.559 0.695 . . . . 0.0 110.094 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.567 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 9.9 p-10 -126.15 70.95 1.24 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.737 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -172.03 92.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.023 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.41 -174.12 3.95 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.87 162.33 16.49 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.076 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -89.31 -174.25 4.32 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.704 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.279 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 tpt . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 120.711 0.291 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt -142.57 143.76 32.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.363 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.707 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.2 tt0 -113.97 126.25 54.93 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.355 0.598 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.481 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.86 108.32 11.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.433 -178.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.894 HG13 ' CD1' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -101.59 109.22 25.32 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.962 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.192 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.681 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -116.91 114.97 24.6 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.468 -178.488 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.667 ' CG1' HD13 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.31 111.94 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.795 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -70.02 91.47 0.68 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -179.704 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.613 HG23 ' CB ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -96.28 -158.88 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 112.152 -178.228 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.85 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 13.3 t70 96.71 -5.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.23 -61.55 1.66 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 175.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.693 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -49.93 -90.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.692 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 33.3 t -179.68 40.25 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.168 0.895 . . . . 0.0 111.229 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.657 ' CZ ' ' CG2' ' A' ' 5' ' ' ILE . 1.1 t80 -82.71 -50.13 9.04 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.527 ' CD ' ' HA ' ' B' ' 110' ' ' ASP . 0.3 OUTLIER -47.39 -38.41 13.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.581 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.504 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.05 -44.0 64.06 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.612 1.096 . . . . 0.0 112.349 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.794 HD13 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -68.07 -47.76 67.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.075 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.585 ' HG2' ' CE1' ' B' ' 114' ' ' TYR . 2.8 pttt -72.06 -29.88 64.58 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.552 0.692 . . . . 0.0 110.483 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.98 -28.75 67.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.463 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.608 ' HB3' HD13 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -88.46 -42.58 12.04 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.591 -0.719 . . . . 0.0 110.476 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.563 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.6 28.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 177.067 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.44 ' CG2' ' O ' ' B' ' 121' ' ' ASP . 68.7 t -160.65 96.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 122.209 -0.307 . . . . 0.0 111.726 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.573 ' O ' ' HE3' ' A' ' 32' ' ' MET . 2.5 m-20 -60.03 -102.75 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 178.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.67 ' HB ' HG22 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -145.12 6.83 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 179.037 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.605 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 2.6 p -41.6 -64.25 0.6 Allowed 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.629 0.728 . . . . 0.0 109.687 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.91 -23.19 42.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.658 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.683 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -62.47 -57.27 11.83 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.719 0.259 . . . . 0.0 111.018 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.67 HG22 ' HB ' ' B' ' 124' ' ' ILE . 5.4 t -54.21 -62.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.763 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 14.8 p -50.42 -44.19 55.09 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 87.5 m -68.55 -57.34 5.92 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.46 ' OG1' HG23 ' A' ' 31' ' ' THR . 0.7 OUTLIER -54.0 -44.41 70.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.397 179.594 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.871 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 5.3 mtt -60.21 -58.02 10.31 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.438 178.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.0 OUTLIER -49.35 -44.56 44.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.4 -179.679 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -64.1 -57.4 9.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.565 0.222 . . . . 0.0 110.778 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.435 ' HB2' HD23 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.4 -15.18 62.81 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -88.69 -29.1 20.13 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 123.234 0.613 . . . . 0.0 111.089 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.58 -48.68 10.7 Favored 'General case' 0 CA--C 1.504 -0.825 0 CA-C-O 121.909 0.861 . . . . 0.0 110.118 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -64.45 -28.45 69.68 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.771 -1.559 . . . . 0.0 114.298 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.606 ' CD1' ' O ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -50.14 144.86 6.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.491 1.042 . . . . 0.0 111.805 -178.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.69 -50.85 0.63 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.848 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.94 65.97 1.12 Allowed 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.796 0.331 . . . . 0.0 111.27 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.402 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -95.79 146.53 24.47 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -179.397 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.426 ' NE ' ' O ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -155.22 109.81 2.96 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.587 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 6.2 p90 -67.55 133.04 48.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.735 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -177.35 155.4 1.11 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.836 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 58.8 t -60.8 120.29 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.172 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -56.71 149.98 16.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.831 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -167.84 148.05 5.05 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.3 60.39 0.1 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.304 0.573 . . . . 0.0 111.097 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -127.46 71.74 1.36 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.66 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -137.97 158.56 24.76 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.881 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.37 -171.07 0.19 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.759 0.314 . . . . 0.0 111.196 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 7.3 p -143.32 -33.91 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.497 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 2.2 pm0 -81.45 151.21 27.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.272 0.558 . . . . 0.0 111.874 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.416 HG21 ' HB3' ' B' ' 172' ' ' TRP . 2.6 m -144.72 85.04 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.862 179.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -138.8 164.37 29.78 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.83 152.38 24.94 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.077 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.477 ' CD2' HG12 ' B' ' 159' ' ' ILE . 0.8 OUTLIER -167.28 165.25 15.29 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.538 0.209 . . . . 0.0 111.421 -179.696 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.477 HG12 ' CD2' ' B' ' 158' ' ' PHE . 21.2 mm 44.91 61.87 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.307 0.575 . . . . 0.0 111.189 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . 0.498 ' HG2' ' HA3' ' B' ' 163' ' ' GLY . 0.6 OUTLIER -114.27 -43.24 3.23 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.704 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.34 -66.93 0.28 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.81 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.15 68.07 0.76 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.373 0.606 . . . . 0.0 110.297 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . 0.498 ' HA3' ' HG2' ' B' ' 160' ' ' GLU . . . -159.01 71.59 0.24 Allowed Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.046 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 72.47 179.32 0.23 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.543 0.211 . . . . 0.0 110.655 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.429 ' HB3' HG21 ' B' ' 122' ' ' VAL . 5.4 t80 -125.0 -85.34 0.64 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 121.182 -0.207 . . . . 0.0 111.363 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -107.15 -108.37 0.31 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.437 ' HB2' ' CE1' ' B' ' 120' ' ' TYR . 26.7 t0 64.41 170.52 0.18 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.052 0.453 . . . . 0.0 111.776 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 63.32 179.13 0.15 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.211 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.411 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 1.7 p30 -119.13 -92.67 0.53 Allowed 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 177.35 77.04 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.95 -49.56 8.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.819 0.342 . . . . 0.0 110.378 178.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.416 ' HB3' HG21 ' B' ' 155' ' ' VAL . 35.7 t-105 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.417 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.875 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.178 0 C5'-C4'-O4' 108.363 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.742 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.614 0.598 0 C4'-C3'-C2' 101.862 -1.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.742 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 C3'-C2'-C1' 104.799 1.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.561 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -1.034 0 C1'-O4'-C4' 108.003 -1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.605 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 C3'-C2'-C1' 104.382 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.491 H2'' ' H8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C4'-C3'-C2' 104.584 1.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.491 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.452 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.711 0 O4'-C1'-C2' 104.797 -1.185 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.459 " O5'" ' H8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 O4'-C1'-C2' 106.933 0.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.473 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.828 0 C1'-O4'-C4' 107.546 -1.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.473 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 N19-C1'-C2' 113.059 -0.713 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 102.04 -0.472 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C1'-O4'-C4' 110.404 0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.874 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.485 0 O4'-C4'-C3' 104.593 -1.007 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.43 ' C6 ' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 O4'-C1'-C2' 107.225 1.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.482 H2'' ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-C2' 107.147 0.952 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.672 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O4'--C1' 1.411 -0.728 0 C4'-C3'-C2' 104.435 1.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.469 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.065 0 C3'-C2'-C1' 104.838 1.527 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.503 " H2'" ' N7 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 105.341 1.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.527 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 105.594 2.067 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.527 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C4'-C3'-C2' 104.273 1.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.845 0.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.016 0 C4'-C3'-C2' 104.56 1.36 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 C1'-O4'-C4' 110.888 0.848 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.845 0 C4'-C3'-C2' 104.268 1.068 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C1'-O4'-C4' 110.305 0.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.516 ' C ' ' HB3' ' B' ' 110' ' ' ASP . 6.9 tpp . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -120.16 101.76 8.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.065 0.46 . . . . 0.0 111.037 179.023 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.724 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -103.81 111.87 24.57 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.344 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.733 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.89 105.89 9.38 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.121 -178.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.644 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -103.94 120.98 54.91 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.993 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 175.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.672 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -124.76 124.15 41.52 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.894 -177.199 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.74 108.08 21.99 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.51 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 27.3 p -70.64 89.96 0.74 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.753 0.311 . . . . 0.0 110.997 -178.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.73 HG22 ' CG ' ' A' ' 14' ' ' TYR . 3.0 t -84.44 -133.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.928 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.521 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.7 t0 85.73 -9.93 0.75 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.166 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.456 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 1.3 t -135.21 -54.19 0.8 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.388 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.713 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.4 m-20 -47.39 -103.28 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -178.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.61 35.32 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.767 0.794 . . . . 0.0 111.05 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.73 ' CG ' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.0 -38.68 22.3 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.595 1.158 . . . . 0.0 112.608 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.628 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.63 -43.99 36.88 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -176.259 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.658 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -54.35 -44.07 71.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.316 0.962 . . . . 0.0 112.26 -179.41 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.845 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -59.15 -52.38 65.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.622 0.725 . . . . 0.0 111.239 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -74.01 -29.37 61.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.752 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.4 -27.93 69.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.267 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.676 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.3 OUTLIER -88.41 -45.02 10.32 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 118.585 -0.722 . . . . 0.0 110.356 179.096 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 159.85 18.89 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.029 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.438 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 65.3 t -157.87 98.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 CA-C-N 118.411 0.551 . . . . 0.0 112.017 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 31.1 m-80 -57.31 -96.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.722 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.71 5.87 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 178.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.63 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.2 t -39.34 -64.58 0.45 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.399 -177.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.86 -25.87 28.38 Favored Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.433 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.693 ' CD1' ' HG ' ' A' ' 17' ' ' LEU . 6.6 tt -58.61 -61.65 2.44 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.992 0.425 . . . . 0.0 109.885 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.722 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.3 t -49.96 -62.8 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.965 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.861 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.877 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 95.4 p -49.45 -43.42 44.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.05 -47.91 40.65 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.254 -0.646 . . . . 0.0 109.254 179.68 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.462 ' CG2' HG22 ' B' ' 131' ' ' THR . 23.3 m -61.47 -34.59 75.72 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.883 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.6 OUTLIER -63.97 -56.86 12.04 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.79 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.502 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -50.23 -34.13 21.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.69 0.281 . . . . 0.0 110.752 179.504 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.4 m-20 -75.36 -50.29 16.4 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.168 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.62 ' HB3' HD22 ' B' ' 117' ' ' LEU . 1.7 mm-40 -67.76 -23.47 65.23 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.06 178.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.65 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.0 -50.12 24.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -56.1 10.42 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.295 178.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.12 -46.03 92.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.394 -178.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.779 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 32.65 67.37 0.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.206 0.527 . . . . 0.0 111.468 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 63.0 ttt-85 -124.03 -87.55 0.62 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.249 -178.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 168.82 157.34 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.812 0.339 . . . . 0.0 111.772 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.33 -148.71 0.27 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.78 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' B' ' 152' ' ' MET . 0.0 OUTLIER -129.09 178.73 6.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 111.077 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.409 ' HD1' ' HB ' ' B' ' 130' ' ' THR . 26.1 m0 -129.93 176.1 8.33 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.165 0.507 . . . . 0.0 112.151 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.456 ' NZ ' ' O ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -80.26 128.06 33.09 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.008 -179.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.5 m -79.08 101.09 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.977 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 33.14 48.89 0.17 Allowed 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 54.85 30.92 14.66 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -95.95 154.32 17.3 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 122.174 -0.329 . . . . 0.0 110.766 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.11 61.91 0.05 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.893 0.378 . . . . 0.0 111.245 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 52' ' ' MET . . . -99.03 -87.87 1.93 Allowed Glycine 0 C--N 1.334 0.447 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.137 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 51' ' ' GLY . 0.0 OUTLIER 51.65 -162.45 0.08 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 122.548 0.339 . . . . 0.0 111.666 -179.395 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.48 -65.44 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-O 120.718 0.294 . . . . 0.0 111.061 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.515 ' HB3' ' CE2' ' A' ' 72' ' ' TRP . 0.4 OUTLIER -157.11 -70.87 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.215 179.428 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.687 ' HA ' ' HB2' ' A' ' 72' ' ' TRP . 2.0 t 52.42 46.04 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.562 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 55' ' ' VAL . . . -18.14 125.68 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.366 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -75.46 143.96 42.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.258 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -58.91 128.02 35.11 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.113 0.482 . . . . 0.0 111.088 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 2.9 tp -113.56 -19.18 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.24 97.75 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.916 0.389 . . . . 0.0 110.895 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -66.04 149.25 50.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.787 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 70.7 38.39 1.25 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.451 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -118.96 -147.76 8.22 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.622 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.7 m -176.49 -104.36 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.544 0.172 . . . . 0.0 110.667 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 54.59 91.01 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -47.4 -63.32 1.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.277 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -152.41 144.84 24.07 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.858 -1.064 . . . . 0.0 109.729 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -135.41 18.6 3.37 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.334 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.455 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 7.4 m-80 61.58 79.09 0.26 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.858 0.361 . . . . 0.0 110.989 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -144.5 147.14 32.89 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.213 -179.682 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.437 ' O ' HG11 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -99.54 -65.61 0.95 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.334 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.687 ' HB2' ' HA ' ' A' ' 55' ' ' VAL . 26.9 t90 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.852 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 111.542 0.201 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -174.35 98.12 0.1 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.155 0.502 . . . . 0.0 110.911 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.521 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 27.2 tt0 -98.79 114.23 26.69 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.887 179.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.499 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.76 102.33 7.12 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.453 -178.164 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.672 ' O ' ' HA ' ' A' ' 6' ' ' THR . 1.1 pt -100.79 109.74 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.71 117.18 29.55 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -175.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.63 HG22 ' HA ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -101.16 104.47 16.31 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 173.794 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.733 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 44.6 p -70.1 85.12 0.54 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.209 0.528 . . . . 0.0 110.774 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.64 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 1.6 t -82.3 -138.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.064 -178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.724 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 4.3 t70 86.03 -5.34 0.8 Allowed 'General case' 0 C--N 1.35 0.624 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -175.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.54 -63.13 1.1 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.508 -1.223 . . . . 0.0 107.919 177.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.877 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -47.25 -92.44 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -179.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 26.6 t -178.82 40.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 118.903 0.774 . . . . 0.0 111.435 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.815 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.9 -41.5 18.83 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.759 0.824 . . . . 0.0 112.529 179.709 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.652 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.75 -39.55 25.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -174.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.65 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.49 -50.72 72.83 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.413 1.006 . . . . 0.0 111.944 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.883 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.1 mt -53.8 -43.57 69.45 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.599 0.714 . . . . 0.0 111.767 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.652 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 7.8 pttt -79.19 -32.53 44.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.52 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -61.93 -26.5 68.22 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.573 -1.194 . . . . 0.0 110.166 178.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.779 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.09 -39.52 14.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.881 179.291 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.636 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 26.2 t0 138.14 49.95 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.562 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 0.3 OUTLIER -159.96 -37.06 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.891 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' B' ' 122' ' ' VAL . 11.9 p30 55.61 -109.61 0.5 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.707 HG23 HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.2 1.38 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.655 ' HA ' ' CG2' ' A' ' 7' ' ' VAL . 13.3 t -38.82 -64.28 0.45 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.871 -178.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -89.35 -26.88 24.4 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.769 177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.568 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -55.66 -61.84 2.09 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.227 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.627 ' O ' ' HG2' ' B' ' 132' ' ' MET . 2.7 t -54.37 -55.49 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.312 0.577 . . . . 0.0 110.044 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.713 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 29.1 t -47.14 -47.66 23.49 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.409 ' HB ' ' HD1' ' A' ' 44' ' ' TRP . 0.5 OUTLIER -83.1 -47.07 12.04 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.657 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.462 HG22 ' CG2' ' A' ' 31' ' ' THR . 2.4 m -56.43 -48.27 77.33 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.695 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.845 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 5.5 mmt -51.62 -48.55 63.25 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.768 179.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -54.58 -36.38 64.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -48.31 46.06 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.543 ' HB3' HD22 ' A' ' 17' ' ' LEU . 5.4 tt0 -74.62 -21.7 59.32 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.943 0.402 . . . . 0.0 110.376 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.658 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.09 -32.98 50.91 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.282 0.633 . . . . 0.0 110.754 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.487 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . 8.2 mtt85 -81.98 -51.97 7.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.592 0.71 . . . . 0.0 110.655 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER -73.95 -21.34 60.06 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -176.673 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.676 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -30.05 100.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.559 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER 171.7 -80.89 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.33 179.091 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 164.49 -87.53 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.785 0.434 . . . . 0.0 111.035 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 47.49 90.49 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -77.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.252 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 22.6 m95 47.32 -97.31 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -174.05 109.24 0.14 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.498 0.19 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.8 p -62.26 150.9 8.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.29 -142.01 0.33 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.074 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -137.5 143.54 41.75 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.826 0.346 . . . . 0.0 110.551 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -81.24 123.46 28.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.827 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.22 141.0 28.97 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.27 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -124.97 122.51 4.71 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.682 -178.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' MET . . . . . 0.432 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 26.7 mtp -114.41 163.14 15.74 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.701 0.286 . . . . 0.0 110.83 179.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.1 t -120.48 167.82 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.91 0.386 . . . . 0.0 111.816 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.517 ' HB2' ' CE3' ' B' ' 172' ' ' TRP . 2.3 mm-40 -106.83 -93.02 0.39 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.396 -178.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.47 HG21 ' CD1' ' B' ' 172' ' ' TRP . 0.0 OUTLIER -108.52 -52.63 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.199 -179.58 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.473 ' HB1' ' HB2' ' B' ' 172' ' ' TRP . . . 41.53 42.73 2.05 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.443 178.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -163.6 109.87 1.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.86 -51.09 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.189 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 3.9 mt -108.82 165.56 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.634 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' B' ' 161' ' ' MET . 0.0 OUTLIER -90.23 -167.31 1.8 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.87 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' MET . . . . . 0.499 ' HB2' ' O ' ' B' ' 160' ' ' GLU . 0.4 OUTLIER 82.46 155.11 0.11 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.361 0.6 . . . . 0.0 111.878 179.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -72.19 104.26 3.59 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.19 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.76 38.74 3.03 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.683 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 53.5 p -169.92 78.47 0.1 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.662 0.268 . . . . 0.0 111.621 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -99.06 -74.78 0.58 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.706 0.289 . . . . 0.0 110.418 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -119.31 -54.95 2.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.345 0.593 . . . . 0.0 110.148 178.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.406 ' CB ' ' HE1' ' B' ' 120' ' ' TYR . 2.1 t0 -153.37 -168.36 2.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 65.79 -158.89 0.27 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.662 -179.602 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' B' ' 168' ' ' GLU . 41.0 m-80 75.34 103.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 -179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 8.0 tptp -70.33 63.53 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.93 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.82 -167.48 1.34 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.279 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.517 ' CE3' ' HB2' ' B' ' 154' ' ' GLU . 83.3 m95 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.021 -0.99 . . . . 0.0 111.814 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.876 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 O4'-C1'-C2' 106.737 0.579 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.776 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.561 0 C3'-C2'-C1' 100.172 -1.805 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.776 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.693 0 C3'-C2'-C1' 106.377 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.679 ' C6 ' " C2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C3'-C2'-C1' 101.558 -0.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.626 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.913 0 N19-C1'-C2' 116.17 1.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.658 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.958 0 C1'-O4'-C4' 107.424 -1.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.595 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.495 0 C3'-C2'-C1' 104.796 1.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.843 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 N19-C1'-C2' 115.559 0.85 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.843 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 107.316 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.633 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.991 0 C3'-C2'-C1' 105.145 1.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.633 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 N19-C1'-C2' 113.162 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.457 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 C3'-C2'-C1' 101.467 -0.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . 0.443 ' N7 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C1'-O4'-C4' 110.516 0.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.883 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.774 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 101.741 -0.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.896 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 101.605 -0.782 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.896 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.858 0 C4'-C3'-C2' 104.701 1.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.579 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.044 0 C1'-O4'-C4' 106.512 -2.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.579 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.747 0 O4'-C1'-C2' 107.424 1.203 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.539 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C3'-C2'-C1' 105.514 2.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.562 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.669 0 C3'-C2'-C1' 105.221 1.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.562 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 O4'-C1'-C2' 106.954 0.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.483 H2'' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.899 0 C4'-C3'-C2' 104.533 1.333 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.605 " O5'" ' H8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 C3'-C2'-C1' 104.997 1.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.532 ' C4 ' ' C6 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 N19-C1'-C2' 115.593 0.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.532 ' C6 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C4'-C3' 106.185 0.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.457 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 111.107 0.039 . . . . 0.0 111.107 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.651 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -20.9 117.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.769 0.668 . . . . 0.0 112.418 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.551 ' O ' ' HA ' ' B' ' 108' ' ' THR . 59.9 tp60 -100.14 120.33 39.71 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.016 0.436 . . . . 0.0 110.869 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.645 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.3 ttm-85 -79.29 112.44 16.52 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -177.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.673 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -118.2 122.18 68.99 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 176.77 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.733 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -131.54 140.36 49.47 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 118.918 -1.113 . . . . 0.0 112.909 -178.168 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.715 HG21 ' HB ' ' A' ' 9' ' ' VAL . 2.0 m -100.83 107.99 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.648 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.7 OUTLIER -70.42 67.64 0.34 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.622 0.725 . . . . 0.0 109.596 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.715 ' HB ' HG21 ' A' ' 7' ' ' VAL . 7.9 p -95.88 -137.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.03 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 1.0 OUTLIER 166.15 -82.83 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -178.903 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.593 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -104.8 9.89 34.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.19 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.733 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -80.22 68.33 6.33 Favored 'General case' 0 C--N 1.359 0.98 0 CA-C-N 119.807 1.185 . . . . 0.0 108.706 179.416 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.479 ' HB3' ' N ' ' B' ' 133' ' ' GLN . 2.6 m 61.16 -28.59 0.05 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.682 -1.144 . . . . 0.0 113.736 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.668 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 0.2 OUTLIER -45.91 -60.26 2.35 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.149 0.5 . . . . 0.0 111.115 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.6 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.3 pt20 -48.75 -38.26 21.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.938 -177.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.595 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.02 -46.56 87.88 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.694 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -55.34 -49.69 71.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.474 0.654 . . . . 0.0 110.849 -179.724 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.659 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.3 pttt -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.538 179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.496 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -59.23 -29.39 67.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.337 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.591 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.3 -44.33 10.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.526 178.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.591 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 152.28 27.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.393 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.498 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 76.4 t -160.15 87.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.634 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -53.89 -87.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.576 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.746 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -155.22 -1.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 179.515 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.639 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 67.3 p -38.91 -64.51 0.44 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-N 118.941 0.791 . . . . 0.0 111.681 -176.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.58 -19.99 57.26 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.774 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.544 ' CD1' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -66.8 -61.66 1.84 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 122.766 0.426 . . . . 0.0 110.741 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.696 HG22 ' HB ' ' A' ' 24' ' ' ILE . 10.0 t -50.55 -60.4 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 C-N-CA 120.309 -0.556 . . . . 0.0 109.923 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.848 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 8.8 p -50.1 -41.78 48.98 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.8 m -67.1 -52.47 41.51 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.1 m -61.24 -34.6 75.4 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.836 178.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.912 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -65.88 -58.15 6.25 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.562 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.458 ' OE1' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.92 -33.99 19.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.718 0.294 . . . . 0.0 110.885 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.41 -50.73 12.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.831 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.522 ' HB3' HD23 ' B' ' 117' ' ' LEU . 1.4 mm-40 -70.83 -19.14 62.69 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.318 177.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.605 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -84.49 -49.11 8.93 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.664 0.786 . . . . 0.0 110.88 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.458 ' HD2' ' OE1' ' A' ' 33' ' ' GLN . 4.7 mtt85 -57.49 -53.7 55.18 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.389 0.614 . . . . 0.0 110.886 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -59.21 -45.44 91.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.869 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.659 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 24.54 94.26 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.42 144.97 33.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.359 0.599 . . . . 0.0 111.842 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.421 ' HB3' ' CG1' ' A' ' 46' ' ' VAL . . . -136.31 -80.36 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.097 178.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -69.3 -71.71 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.301 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp-105 -166.29 -52.17 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.759 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.47 -95.4 0.44 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -99.67 118.5 36.33 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.705 0.288 . . . . 0.0 111.242 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.421 ' CG1' ' HB3' ' A' ' 41' ' ' ALA . 1.4 p -128.77 -77.66 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.546 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -136.32 135.54 38.97 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.842 0.354 . . . . 0.0 111.574 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -144.37 140.71 29.23 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -115.23 138.01 51.4 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.061 0.458 . . . . 0.0 111.985 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -109.24 132.9 53.68 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.156 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 119.98 -148.67 17.9 Favored Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.127 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.71 83.66 0.13 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.013 0.435 . . . . 0.0 111.736 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -160.1 168.76 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -64.09 1.02 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.752 ' HA ' ' CE2' ' A' ' 72' ' ' TRP . 12.0 t 70.92 10.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.287 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 46.52 32.14 1.54 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.052 0.453 . . . . 0.0 111.652 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.441 ' HD3' ' HB ' ' A' ' 55' ' ' VAL . 23.9 ptt180 -109.47 -17.04 13.86 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.31 -47.05 5.58 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.59 0.233 . . . . 0.0 111.322 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.407 ' CD1' ' HG2' ' A' ' 61' ' ' MET . 0.0 OUTLIER -137.53 153.63 28.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.284 -179.84 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -117.19 114.57 23.85 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.126 0.489 . . . . 0.0 111.607 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 61' ' ' MET . 0.5 OUTLIER -171.12 123.46 0.59 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.9 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -73.32 -70.82 0.34 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.759 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 64' ' ' SER . . . 73.76 162.99 8.37 Favored Glycine 0 C--N 1.337 0.596 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.44 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 98.9 p 174.53 113.98 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.764 0.282 . . . . 0.0 111.522 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -101.72 -70.32 0.75 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.857 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.536 ' HB3' ' HB3' ' A' ' 21' ' ' ASP . . . -162.29 -118.95 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.444 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.413 ' O ' HG21 ' A' ' 22' ' ' VAL . 3.5 m-20 -84.54 80.83 9.1 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.058 0.456 . . . . 0.0 110.848 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -124.73 177.56 5.92 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.035 -179.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.21 136.97 40.2 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.863 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.11 116.65 17.3 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.848 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -93.04 -50.19 5.65 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.913 179.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.752 ' CE2' ' HA ' ' A' ' 55' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.493 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 120.509 0.195 . . . . 0.0 111.384 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.427 ' HD3' ' OP2' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -168.58 163.02 12.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.052 179.787 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.514 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 3.3 tt0 -109.93 110.57 21.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.132 0.492 . . . . 0.0 112.129 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.448 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 7.8 ttm105 -78.69 102.38 8.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.649 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -99.09 116.09 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 178.891 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.733 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -115.74 124.5 50.96 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.599 -176.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.641 HG21 ' HB ' ' A' ' 24' ' ' ILE . 1.1 t -100.6 98.7 7.23 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.645 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 48.4 p -70.16 98.66 1.37 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.97 -0.456 . . . . 0.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.758 ' CG2' ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -88.98 -129.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.421 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 22.5 t70 85.47 -9.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 67.3 p -131.5 -61.33 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.824 178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.848 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.27 -92.54 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 28.5 t 170.85 39.38 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.731 0.776 . . . . 0.0 110.149 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.912 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -84.23 -45.17 13.16 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.26 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.479 ' HA ' ' CE ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.7 -34.92 12.87 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.305 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -60.71 -56.92 15.51 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.678 0.672 . . . . 0.0 111.549 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.903 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.9 mt -47.16 -48.85 23.36 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.069 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.658 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -77.04 -26.21 53.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.643 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.82 -30.4 71.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.699 178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.659 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.16 -41.41 13.02 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.789 178.408 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.563 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 152.95 26.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.029 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.578 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.6 OUTLIER -135.29 80.1 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -179.001 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.579 ' O ' HD13 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.69 53.74 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.652 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.733 HG22 ' HE3' ' A' ' 32' ' ' MET . 0.4 OUTLIER 42.35 -9.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 118.701 2.852 . . . . 0.0 118.701 178.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.553 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.25 -63.15 0.51 Allowed 'General case' 0 C--O 1.244 0.773 0 CA-C-N 119.601 1.091 . . . . 0.0 110.946 -176.966 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.49 -26.78 34.72 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.693 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.59 ' CD1' ' CD1' ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.4 -61.51 2.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.628 0.371 . . . . 0.0 110.436 179.332 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.649 HG23 ' HB ' ' B' ' 124' ' ' ILE . 4.0 t -47.74 -64.31 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.733 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.05 -34.8 10.06 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 178.574 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 98.8 m -72.44 -52.8 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -42.55 99.14 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.424 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.746 ' HE3' ' CG2' ' A' ' 24' ' ' ILE . 6.7 mmt -52.31 -51.17 60.13 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.674 179.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.479 ' N ' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.92 -36.91 68.25 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.702 0.287 . . . . 0.0 111.079 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.4 -52.51 26.25 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.564 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 1.2 mp0 -70.77 -19.21 62.73 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.61 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.595 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.45 -28.82 21.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 122.776 0.43 . . . . 0.0 111.243 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -54.07 6.39 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 121.652 0.739 . . . . 0.0 109.871 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -83.42 -37.87 22.66 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.12 -178.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.565 HD23 ' CD2' ' A' ' 20' ' ' TYR . 2.2 mp 48.23 -85.01 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.645 0.778 . . . . 0.0 112.1 -178.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.41 -59.39 2.55 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.456 0.169 . . . . 0.0 111.342 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 57.54 -159.75 0.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -123.34 163.8 20.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.955 0.407 . . . . 0.0 111.31 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.94 59.76 3.9 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -87.11 -40.91 14.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.144 -179.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -74.85 86.84 2.25 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 120.987 0.422 . . . . 0.0 111.821 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.446 HG12 ' HG2' ' B' ' 147' ' ' GLU . 25.8 t -81.29 134.73 26.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.446 ' HG2' HG12 ' B' ' 146' ' ' VAL . 2.0 mm-40 65.85 98.67 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.423 0.63 . . . . 0.0 111.612 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' B' ' 149' ' ' GLN . 16.3 t30 -102.76 -145.33 0.36 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.676 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . 0.447 ' HB2' ' O ' ' B' ' 148' ' ' ASN . 33.6 mt-30 73.12 -55.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.438 0.295 . . . . 0.0 111.379 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.41 130.59 44.35 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 110.716 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -115.91 9.61 18.57 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.871 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -116.83 86.44 2.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.339 0.569 . . . . 0.0 111.105 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 8.9 p -117.04 -46.63 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.46 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.04 -58.31 0.85 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 111.136 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.569 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 16.4 t 76.45 3.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 176.33 150.95 0.14 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.892 0.377 . . . . 0.0 111.529 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . 0.423 ' HD2' ' HA ' ' B' ' 157' ' ' ARG . 8.7 tpt180 -175.19 -50.87 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.618 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -103.05 163.12 12.41 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.848 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.474 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 1.8 pp -35.72 142.56 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.37 -179.21 0.44 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.883 -179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.77 -65.07 0.5 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.481 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -103.44 -59.8 1.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.581 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 137.26 -87.18 0.23 Allowed Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.547 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.1 84.03 1.39 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -106.78 178.03 4.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -44.26 -63.6 0.85 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.01 0.433 . . . . 0.0 111.162 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.567 ' HB3' ' CE1' ' B' ' 120' ' ' TYR . 12.6 t70 -165.16 105.27 0.77 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.936 179.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.13 111.58 0.1 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.676 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -151.85 165.94 32.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.06 0.457 . . . . 0.0 111.879 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.474 ' NZ ' ' O ' ' B' ' 159' ' ' ILE . 2.6 pttt -87.96 152.84 21.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.945 178.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.84 145.15 56.34 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.603 0.24 . . . . 0.0 110.432 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.569 ' CE2' ' HA ' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.301 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.881 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C1'-O4'-C4' 110.624 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C1'-O4'-C4' 110.485 0.561 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 104.124 1.017 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.648 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.918 0 C4'-C3'-C2' 104.661 1.461 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.601 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C4'-C3'-C2' 104.729 1.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.601 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.411 -0.672 0 C4'-C3'-C2' 104.491 1.291 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.493 ' C5 ' ' C4 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.535 0 C3'-C2'-C1' 104.487 1.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.493 ' C4 ' ' C5 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.74 0 O4'-C1'-C2' 104.998 -1.002 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.495 " O5'" ' H8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 O4'-C1'-C2' 107.138 0.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.473 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.524 0.647 0 C3'-C2'-C1' 105.801 2.215 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.583 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C1'-C2' 106.848 0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.583 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 101.81 -0.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 106.908 0.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.89 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 107.027 0.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.516 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C4'-C3'-C2' 102.419 -0.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.516 ' C8 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C1'-O4'-C4' 110.393 0.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.885 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.698 0 C4'-C3'-C2' 101.343 -1.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.885 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C4'-C3'-C2' 104.26 1.06 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.664 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C5'-C4'-O4' 108.741 -0.412 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 104.928 1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.417 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.411 -0.718 0 C4'-C3'-C2' 104.796 1.596 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.413 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-C2' 107.101 0.91 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.413 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C1'-O4'-C4' 107.045 -1.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.455 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 C4'-C3'-C2' 104.312 1.112 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 O4'-C1'-C2' 104.836 -1.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C1'-O4'-C4' 110.279 0.413 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.563 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -163.08 122.34 2.15 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.93 0.395 . . . . 0.0 110.981 179.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.718 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 36.7 tp60 -109.66 117.51 34.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.232 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.765 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.5 ttm180 -78.51 106.12 10.25 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 121.67 0.748 . . . . 0.0 112.221 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.647 ' CD1' ' CD1' ' B' ' 114' ' ' TYR . 7.0 pt -110.41 128.1 66.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 177.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.711 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.03 131.6 42.62 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 118.461 -1.295 . . . . 0.0 113.822 -177.497 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.552 HG12 ' CD1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.48 105.39 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.6 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 7.4 p -70.55 91.68 0.8 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.281 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.651 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -88.58 -147.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.805 -178.908 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.589 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 28.4 t70 120.49 -0.28 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.327 1.051 . . . . 0.0 108.511 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.9 p -158.03 -33.12 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.079 -0.964 . . . . 0.0 112.694 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.72 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -75.05 19.9 0.14 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -176.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.56 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 32.5 m 81.38 8.23 1.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 175.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.905 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -63.25 -45.77 90.01 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 7.4 mt-30 -49.62 -41.24 41.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -176.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.578 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -59.53 -48.46 81.56 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.724 HD22 ' HB3' ' B' ' 135' ' ' GLU . 0.4 OUTLIER -50.34 -56.91 9.3 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.525 0.679 . . . . 0.0 111.498 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.635 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 pttt -70.4 -25.83 63.41 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.113 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.496 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . . . -65.71 -27.03 68.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.325 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.68 ' CD2' ' HG ' ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.11 -38.69 15.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 118.316 -0.85 . . . . 0.0 110.264 178.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.3 m-20 148.98 33.84 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 21' ' ' ASP . 41.0 t -151.08 88.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 121.821 -0.55 . . . . 0.0 112.429 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.564 ' O ' HD12 ' A' ' 24' ' ' ILE . 63.4 m-80 -70.04 60.82 0.18 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.3 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.796 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 40.65 -11.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 118.539 2.792 . . . . 0.0 118.539 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.501 ' N ' ' O ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -38.1 -62.05 0.6 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.773 1.17 . . . . 0.0 110.787 -177.619 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.02 -30.97 40.59 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.231 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.509 HD12 ' CD1' ' A' ' 17' ' ' LEU . 2.8 tp -60.27 -61.68 2.42 Favored 'General case' 0 C--N 1.338 0.074 0 O-C-N 122.916 -0.167 . . . . 0.0 111.001 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.796 HG21 ' HB ' ' A' ' 24' ' ' ILE . 37.2 t -45.66 -66.31 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.063 0.459 . . . . 0.0 110.986 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.711 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 15.3 p -49.39 -44.08 44.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.418 ' O ' ' HG2' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -72.72 -44.85 61.19 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.177 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 m -54.42 -38.16 65.93 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.559 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.785 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 5.5 mmt -56.34 -57.38 12.52 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.58 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 30' ' ' THR . 4.5 pt20 -50.44 -38.63 44.45 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.74 0.305 . . . . 0.0 111.317 -179.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -69.88 -51.67 31.23 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.431 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.56 ' HB3' HD22 ' B' ' 117' ' ' LEU . 4.5 tp10 -68.72 -23.11 64.32 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.273 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -79.31 -46.02 18.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.572 0.349 . . . . 0.0 110.689 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.27 -50.8 68.71 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.913 0.863 . . . . 0.0 109.971 178.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.542 ' HD3' ' O ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -83.76 -49.93 8.62 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.392 -1.731 . . . . 0.0 113.486 -177.2 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.802 ' CD1' ' CE2' ' B' ' 120' ' ' TYR . 62.7 mt 48.58 93.18 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.467 0.707 . . . . 0.0 111.865 -178.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.58 ' HA ' ' O ' ' B' ' 168' ' ' GLU . 0.0 OUTLIER 81.9 -108.57 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.507 179.573 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.49 ' HB2' ' HG2' ' A' ' 38' ' ' ARG . . . 67.68 127.01 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.219 0.533 . . . . 0.0 112.01 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.01 80.96 8.99 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.545 ' HG3' ' HB2' ' B' ' 147' ' ' GLU . 0.0 OUTLIER -175.47 120.35 0.19 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.219 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -127.1 -156.14 0.73 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.91 -179.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.487 ' HE3' ' HB ' ' B' ' 153' ' ' VAL . 0.0 OUTLIER -76.15 166.85 22.87 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.519 0.676 . . . . 0.0 112.472 -179.036 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.9 p -167.45 127.58 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.485 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -107.67 103.02 12.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.058 0.456 . . . . 0.0 111.349 -179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -148.15 35.93 0.83 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.197 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -139.89 120.16 13.87 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 120.787 0.327 . . . . 0.0 111.612 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -93.53 152.79 18.82 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.701 179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -167.4 -120.64 0.53 Allowed Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.795 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.2 ptp 179.42 -47.89 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.575 0.226 . . . . 0.0 111.541 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.0 m -109.32 160.69 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-O 120.793 0.33 . . . . 0.0 111.815 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.556 ' HB2' ' HB3' ' A' ' 72' ' ' TRP . 67.8 mm-40 -53.05 -65.15 0.61 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.249 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.556 ' HA ' ' CE2' ' A' ' 72' ' ' TRP . 4.0 t 60.08 10.04 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.419 ' O ' ' HD2' ' B' ' 143' ' ' ARG . . . 41.63 41.16 1.6 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.158 0.504 . . . . 0.0 111.296 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -128.44 95.85 4.26 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.554 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -161.32 173.95 14.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.617 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.6 pt -109.58 -100.45 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.15 -165.01 0.2 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.554 0.216 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.0 ttp -100.04 41.82 1.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.649 0.261 . . . . 0.0 111.504 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.531 ' HB2' ' HB2' ' B' ' 145' ' ' LYS . 1.0 OUTLIER 69.84 -57.88 0.54 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.924 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.31 176.91 51.6 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.15 -0.547 . . . . 0.0 112.116 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.533 ' O ' ' HB3' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -102.58 -89.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.548 0.174 . . . . 0.0 110.653 179.721 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.533 ' HB3' ' O ' ' A' ' 64' ' ' SER . 4.7 p90 172.18 171.47 0.11 Allowed 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.975 0.417 . . . . 0.0 111.098 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.78 -84.25 0.42 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.953 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -161.79 -75.91 0.05 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.205 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.79 -29.38 13.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.507 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -37.13 113.9 0.28 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.379 0.672 . . . . 0.0 112.493 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.9 110.98 0.17 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.118 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -139.45 -61.86 0.54 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.556 ' HB3' ' HB2' ' A' ' 54' ' ' GLU . 2.0 t90 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.112 -0.946 . . . . 0.0 110.995 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 120.212 0.053 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.57 ' HG3' ' C7 ' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -34.39 122.83 0.51 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.421 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 7.6 tt0 -100.34 113.28 25.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.591 178.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.596 ' HG3' HG21 ' A' ' 8' ' ' THR . 4.5 ttm180 -78.38 101.11 7.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.218 0.532 . . . . 0.0 110.607 -179.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.704 HG22 ' CD1' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -99.36 118.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.41 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.711 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -123.22 123.21 40.26 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.152 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.591 HG21 ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.45 103.33 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 175.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.765 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 64.9 p -70.06 67.9 0.3 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.652 0.739 . . . . 0.0 109.751 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.683 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 8.0 p -70.31 -130.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 114.13 -1.396 . . . . 0.0 111.831 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.718 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 25.9 t70 84.89 -5.38 0.95 Allowed 'General case' 0 N--CA 1.485 1.292 0 CA-C-N 119.893 1.224 . . . . 0.0 109.603 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.29 -64.54 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.642 177.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.711 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.81 -84.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.265 -179.816 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.96 44.29 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.132 0.491 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.785 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.3 OUTLIER -83.35 -44.83 14.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.6 mp0 -48.85 -38.95 23.85 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.505 HD21 ' OH ' ' B' ' 120' ' ' TYR . 0.5 OUTLIER -50.17 -56.72 9.84 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.727 0.694 . . . . 0.0 111.761 179.516 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.587 ' HG ' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -58.33 -48.51 80.31 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.034 -179.005 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -73.41 -26.33 60.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.287 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.91 -25.25 42.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.874 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.802 ' CE2' ' CD1' ' A' ' 39' ' ' LEU . 1.4 m-30 -87.97 -51.72 5.66 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.616 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.6 m-20 144.45 48.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 O-C-N 124.36 1.038 . . . . 0.0 112.096 177.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.542 ' CG1' HD12 ' B' ' 117' ' ' LEU . 5.3 p -150.69 85.76 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.538 ' O ' HD12 ' B' ' 124' ' ' ILE . 43.1 m-80 -68.3 59.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.734 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.74 HG12 ' HE1' ' A' ' 32' ' ' MET . 0.8 OUTLIER 37.42 1.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 178.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.09 -62.35 0.57 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.584 1.083 . . . . 0.0 110.373 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -83.33 -31.87 26.87 Favored Glycine 0 C--O 1.223 -0.574 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.169 178.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.703 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.66 -62.02 2.02 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.795 0.438 . . . . 0.0 111.888 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.776 HG22 HG22 ' A' ' 28' ' ' VAL . 1.8 t -52.34 -64.7 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.145 0.497 . . . . 0.0 110.929 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.72 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 84.6 p -50.46 -41.63 53.21 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.816 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.425 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 7.6 m -65.7 -51.88 55.8 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.1 -38.52 62.65 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.879 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.905 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.2 mtt -58.11 -55.52 33.83 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.974 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.549 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -50.57 -39.98 51.04 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.21 0.459 . . . . 0.0 111.115 179.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -68.79 -52.54 29.19 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.663 0.268 . . . . 0.0 110.754 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.724 ' HB3' HD22 ' A' ' 17' ' ' LEU . 22.6 tp10 -68.76 -22.03 64.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.208 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.578 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -80.08 -46.77 15.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.424 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -53.31 59.09 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 121.581 0.705 . . . . 0.0 110.325 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.481 ' HG2' ' HB2' ' B' ' 141' ' ' ALA . 0.5 OUTLIER -71.59 -51.74 21.78 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.166 -178.888 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.68 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 37.15 33.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -179.75 59.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.481 ' HB2' ' HG2' ' B' ' 138' ' ' ARG . . . -168.51 130.28 1.33 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.52 129.0 1.53 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.682 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.419 ' HD2' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -166.43 -82.15 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.559 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.418 ' O ' ' HA ' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -145.85 176.58 9.57 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.907 0.384 . . . . 0.0 111.774 -179.48 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -115.72 -89.56 0.56 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.025 -178.929 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.4 m 41.86 68.43 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.545 ' HB2' ' HG3' ' A' ' 43' ' ' ARG . 1.4 pm0 -84.59 141.95 30.31 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.693 178.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -112.47 -85.19 0.58 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' B' ' 150' ' ' GLU . 10.8 tt0 -160.23 107.59 1.61 Allowed 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.443 0.164 . . . . 0.0 111.443 -179.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 149' ' ' GLN . 0.7 OUTLIER 176.27 148.61 0.11 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.502 179.683 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -177.05 146.86 8.02 Favored Glycine 0 C--N 1.335 0.504 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.118 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 1.1 ttp 178.89 -34.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . 0.487 ' HB ' ' HE3' ' A' ' 45' ' ' LYS . 90.6 t -68.12 95.96 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.575 0 CA-C-O 121.005 0.431 . . . . 0.0 111.891 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -141.06 179.14 6.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.89 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.501 ' CG2' ' CZ2' ' B' ' 172' ' ' TRP . 0.8 OUTLIER -151.94 -42.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.318 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 62.94 84.58 0.14 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.229 0.538 . . . . 0.0 111.347 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.39 32.21 3.11 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 -176.71 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.739 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 6.6 mt -131.88 120.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.73 0.3 . . . . 0.0 111.352 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.29 91.52 0.74 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.294 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 19.8 tpp -96.85 59.65 1.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.987 0.422 . . . . 0.0 111.141 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -176.96 -163.8 0.09 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.747 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 165.72 -61.89 0.23 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.482 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 2.2 m -58.17 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.462 ' CG ' HG23 ' B' ' 122' ' ' VAL . 1.0 OUTLIER -147.89 166.91 26.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.784 179.612 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.639 ' CB ' ' HB2' ' B' ' 120' ' ' TYR . . . -51.24 -88.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.709 ' HB2' HD22 ' A' ' 39' ' ' LEU . 4.3 m-20 -125.82 -74.13 0.61 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.812 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.58 ' O ' ' HA ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER 35.16 -134.4 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.436 0.46 . . . . 0.0 112.095 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.9 m120 65.69 167.14 0.19 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.173 0.442 . . . . 0.0 110.814 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.39 -86.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -158.79 -66.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.696 0.284 . . . . 0.0 111.193 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.501 ' CZ2' ' CG2' ' B' ' 155' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.567 -0.73 . . . . 0.0 109.996 179.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.875 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C3'-C2'-C1' 104.923 1.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.75 " O4'" " H1'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 P-O3'-C3' 120.881 0.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.555 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 C3'-C2'-C1' 104.66 1.4 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.6 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C4'-C3'-C2' 104.652 1.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.607 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 C4'-C3'-C2' 104.723 1.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.607 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C4'-C3'-C2' 104.583 1.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.465 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 104.552 1.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.58 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.752 0 O4'-C1'-C2' 104.761 -1.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.58 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.496 0 O4'-C1'-C2' 107.216 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.621 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.737 0 C3'-C2'-C1' 105.611 2.08 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.621 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-C2' 107.033 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.571 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C4'-C3'-C2' 103.974 0.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 107.063 0.875 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.88 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-C2' 107.005 0.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.937 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C5'-C4'-C3' 115.643 0.629 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.937 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 C4'-C3'-C2' 103.964 0.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.475 " O5'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.52 0 O4'-C1'-C2' 106.921 0.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.539 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.966 0 C1'-O4'-C4' 106.792 -2.077 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.648 H2'' " O5'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.902 0 C1'-O4'-C4' 107.449 -1.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.648 " O5'" H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 C3'-C2'-C1' 106.49 2.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.562 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 105.191 1.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.562 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 O4'-C1'-C2' 107.254 1.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.529 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.022 0 C1'-O4'-C4' 107.655 -1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.529 " O5'" H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.612 0 O4'-C1'-C2' 106.901 0.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 N19-C1'-C2' 115.444 0.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 102.096 -0.431 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.2 ptp . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 120.65 0.262 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.5 mttp 55.74 68.72 0.82 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.919 0.39 . . . . 0.0 111.554 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.592 ' N ' ' O ' ' B' ' 109' ' ' VAL . 5.0 tp60 -69.58 115.15 8.49 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.138 0.494 . . . . 0.0 110.211 178.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.874 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.4 OUTLIER -78.1 99.23 6.07 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.778 0.799 . . . . 0.0 109.072 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.693 ' O ' ' HA ' ' B' ' 106' ' ' THR . 1.9 pt -99.34 120.22 48.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 107.022 -1.474 . . . . 0.0 107.022 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.67 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.66 126.21 34.07 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 118.755 -1.178 . . . . 0.0 114.129 -176.661 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -99.45 109.47 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 175.869 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.451 HG22 ' HG3' ' B' ' 104' ' ' ARG . 1.6 p -70.67 94.77 1.04 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.766 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -99.59 -120.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.368 -177.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.626 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 4.7 t70 97.32 11.85 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 CA-C-O 122.088 0.946 . . . . 0.0 109.144 -175.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -170.69 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.386 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.758 ' HB2' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.74 49.97 0.07 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -176.491 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.646 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.6 OUTLIER 52.26 12.59 0.23 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.448 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.873 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -67.17 -57.4 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.535 0.683 . . . . 0.0 112.159 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.788 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 6.6 mt-30 -50.29 -28.71 8.27 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.418 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -62.76 -57.17 11.87 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.416 0.553 . . . . 0.0 111.655 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.935 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 1.0 OUTLIER -47.26 -48.56 24.54 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.89 0.852 . . . . 0.0 111.9 -179.187 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.687 ' CB ' ' HA ' ' A' ' 23' ' ' ASN . 3.5 pttt -79.27 -26.41 42.36 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.682 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.481 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -69.7 -22.96 63.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.005 179.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.533 ' CD2' ' CD2' ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.01 -41.24 13.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.871 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 167.12 -12.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 177.045 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.594 ' O ' ' N ' ' A' ' 24' ' ' ILE . 75.2 t -109.6 80.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-O 120.539 0.209 . . . . 0.0 111.206 -178.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.687 ' HA ' ' CB ' ' A' ' 18' ' ' LYS . 61.6 m-80 -63.4 60.69 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.185 0.517 . . . . 0.0 111.036 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.654 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.1 OUTLIER 46.01 -21.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 178.597 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.66 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.28 -63.8 0.47 Allowed 'General case' 0 C--O 1.245 0.862 0 CA-C-N 118.534 0.606 . . . . 0.0 112.21 -173.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.04 -14.26 72.58 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.29 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.694 ' HG ' HD12 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -65.97 -61.26 2.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 122.343 0.257 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.644 ' O ' ' HG2' ' A' ' 32' ' ' MET . 55.7 t -51.09 -59.21 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.667 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 25.7 p -49.35 -36.81 22.58 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.532 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -74.31 -56.08 5.29 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.424 ' CB ' HG21 ' B' ' 131' ' ' THR . 0.6 OUTLIER -56.05 -44.37 78.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.696 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.833 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 6.6 mmt -52.57 -46.12 66.75 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.707 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.436 ' N ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.831 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -60.49 -51.81 67.87 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -34.08 76.97 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -67.17 -45.39 77.12 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.999 0.428 . . . . 0.0 109.906 177.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.53 -53.56 56.68 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.61 0.719 . . . . 0.0 109.986 178.419 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -68.23 -53.41 24.88 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.123 -178.963 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.6 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 24.23 69.83 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.966 0.907 . . . . 0.0 112.713 179.66 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -168.3 -75.76 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.134 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.29 -176.7 2.97 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.596 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.491 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -113.48 -74.97 0.61 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.86 131.52 44.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.296 0.57 . . . . 0.0 112.409 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -138.92 75.01 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.326 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 5.4 ptpt 48.64 58.73 4.95 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.582 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.0 t -138.33 72.36 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.084 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -100.37 -53.65 3.06 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.563 0.221 . . . . 0.0 110.979 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -147.95 120.83 8.73 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.777 0.322 . . . . 0.0 111.56 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -145.68 -76.17 0.21 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.244 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 63.67 102.84 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.351 0.596 . . . . 0.0 112.498 178.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.54 103.56 1.21 Allowed Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.556 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.7 ptm -110.31 72.2 0.78 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.174 0.511 . . . . 0.0 111.29 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 p -132.95 80.38 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.485 0.66 . . . . 0.0 110.282 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.56 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -108.68 101.35 10.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.723 -178.438 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.35 64.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.831 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -139.86 165.93 25.98 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.135 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.505 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 18.4 mmt180 -160.82 -177.89 6.46 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.711 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.505 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 90.3 m-85 75.62 106.44 0.08 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.857 0.463 . . . . 0.0 111.559 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.9 mt 66.61 82.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.214 0.53 . . . . 0.0 111.057 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.76 98.23 0.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.837 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 14.1 mmm -113.1 173.29 6.46 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 111.841 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -66.44 65.38 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.196 -179.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.29 -84.26 0.52 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.908 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 89.9 p -155.2 -88.31 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.477 0.18 . . . . 0.0 111.353 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -142.8 -60.95 0.43 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.247 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -160.67 -121.69 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.621 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -95.88 100.69 12.35 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.959 0.409 . . . . 0.0 111.8 -179.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.65 29.68 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.825 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 28.99 66.47 0.1 Allowed 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.65 71.49 6.77 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.173 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.78 -175.84 6.0 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.005 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.56 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 23.8 m-90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.237 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' B' ' 102' ' ' LYS . 2.9 mpp? . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.475 ' HD3' " H3'" ' C' ' 175' ' ' ' DA' . 0.0 OUTLIER -136.37 135.84 39.13 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.736 0.303 . . . . 0.0 110.503 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.626 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 14.4 tt0 -125.93 120.16 29.67 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.555 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 7.6 ttm-85 -79.69 116.6 19.97 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.197 -178.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.67 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -113.36 129.77 68.53 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 176.424 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.693 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -129.12 131.7 47.27 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.262 -0.975 . . . . 0.0 112.461 -178.395 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.66 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.96 91.14 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.874 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 23.8 p -69.13 67.54 0.17 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 122.258 1.027 . . . . 0.0 109.735 -178.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 3' ' ' GLN . 15.0 p -99.72 -129.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 113.717 -1.583 . . . . 0.0 110.623 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 0.4 OUTLIER 161.52 -84.84 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.008 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.423 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 45.2 t -102.8 11.25 37.81 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.815 -0.612 . . . . 0.0 112.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.667 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 3.1 t0 -79.24 61.32 3.31 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-N 119.785 1.175 . . . . 0.0 108.105 179.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 29' ' ' SER . 66.0 m 63.33 -22.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.995 -1.002 . . . . 0.0 113.146 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.78 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -47.02 -59.53 3.06 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-O 121.14 0.495 . . . . 0.0 110.852 179.399 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.616 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.8 pt20 -48.49 -38.86 21.23 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.927 -177.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -41.38 74.71 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.343 0.52 . . . . 0.0 112.051 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.833 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -64.62 -45.97 84.62 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.006 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.78 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -74.55 -26.05 59.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 178.782 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -65.46 -34.27 77.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.531 178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.6 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.21 -26.87 22.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.661 179.134 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.586 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 31.1 t70 124.76 61.32 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.589 HG21 ' CE1' ' B' ' 120' ' ' TYR . 24.2 t -156.0 -47.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.507 ' CG ' ' HB3' ' B' ' 118' ' ' LYS . 12.8 m-80 68.69 -112.55 0.11 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 -176.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.643 HG13 ' HE2' ' A' ' 32' ' ' MET . 0.1 OUTLIER -150.02 1.69 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 177.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.421 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.89 -63.44 0.59 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.798 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.37 -30.04 20.39 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.071 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.56 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 10.5 tp -56.51 -61.6 2.3 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.624 0.212 . . . . 0.0 110.441 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.596 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.3 t -48.76 -60.12 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.72 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 2.2 t -49.0 -46.56 44.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -51.51 39.39 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.424 HG21 ' CB ' ' A' ' 31' ' ' THR . 23.5 m -59.6 -36.02 75.46 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.584 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.935 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 1.9 mmt -62.9 -57.9 9.23 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.219 -179.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 1.0 OUTLIER -54.49 -33.46 59.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.512 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.04 -52.35 11.28 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' A' ' 27' ' ' LEU . 78.7 mm-40 -71.25 -20.99 62.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.012 0.434 . . . . 0.0 110.363 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.05 -31.88 34.28 Favored 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 123.122 0.569 . . . . 0.0 110.84 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -80.28 -52.55 7.58 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.58 0.705 . . . . 0.0 110.68 179.535 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 -78.72 -36.62 43.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.489 -1.232 . . . . 0.0 112.704 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.589 ' O ' ' HB2' ' B' ' 140' ' ' ARG . 0.1 OUTLIER 31.61 41.52 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.744 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.589 ' HB2' ' O ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER 162.26 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.061 0.544 . . . . 0.0 110.646 179.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -143.02 151.27 40.65 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.898 0.38 . . . . 0.0 111.811 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.97 -145.56 0.39 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.186 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -150.15 55.04 0.93 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 120.974 0.416 . . . . 0.0 111.523 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -74.49 63.35 1.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.276 0.56 . . . . 0.0 111.41 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.95 129.18 27.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.139 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.0 p -151.91 89.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.27 0.557 . . . . 0.0 111.958 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' B' ' 148' ' ' ASN . 15.7 mt-10 -141.0 -113.8 0.13 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' B' ' 147' ' ' GLU . 0.3 OUTLIER 77.0 122.25 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.289 0.566 . . . . 0.0 111.808 179.304 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.08 -55.44 0.15 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.773 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -90.72 174.72 7.33 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.789 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -112.05 -57.53 0.45 Allowed Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.918 -0.658 . . . . 0.0 113.036 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.57 149.52 46.14 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.938 0.399 . . . . 0.0 111.383 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 14.4 p -167.7 47.54 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.301 0.572 . . . . 0.0 111.649 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -107.45 165.93 11.03 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.457 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.01 30.59 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.553 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -85.0 125.82 33.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.243 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.5 90.3 3.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.893 0.378 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.4 t80 60.38 66.76 0.91 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.838 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.3 pp -145.15 34.98 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.479 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' B' ' 161' ' ' MET . 0.0 OUTLIER 64.54 -177.85 0.17 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 161' ' ' MET . . . . . 0.404 ' N ' ' HG3' ' B' ' 160' ' ' GLU . 1.3 ttt -168.72 106.9 0.45 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.788 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -136.95 158.08 45.28 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.236 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 131.7 -145.14 16.84 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.612 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.3 -172.18 4.11 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.771 0.32 . . . . 0.0 111.236 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.424 ' O ' ' HB1' ' B' ' 166' ' ' ALA . 30.2 m-85 -118.92 145.51 45.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.434 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.459 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . 72.17 9.56 5.96 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -131.61 -77.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.929 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -115.19 50.6 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.228 0.537 . . . . 0.0 110.449 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.34 -29.45 63.82 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.38 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 1.1 pttm 34.75 42.05 0.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.408 ' HB3' ' CE3' ' B' ' 172' ' ' TRP . 93.2 m-20 67.47 -60.43 0.38 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.928 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.408 ' CE3' ' HB3' ' B' ' 171' ' ' ASP . 27.1 p90 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.92 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.886 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 111.075 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.868 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.831 0 P-O3'-C3' 120.739 0.866 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.764 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.484 0 C3'-C2'-C1' 104.814 1.51 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.524 ' C7 ' " H2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.714 0 C3'-C2'-C1' 105.43 1.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.522 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.783 0 C4'-C3'-C2' 104.79 1.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.522 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C4'-C3'-C2' 104.206 1.006 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.435 ' C8 ' ' C2 ' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 104.862 1.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.512 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C4'-C3'-C2' 104.037 0.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.512 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.183 0.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.491 " H3'" HO5' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C3'-C2'-C1' 105.689 2.135 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.577 H2'' ' C5 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 104.125 1.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.577 ' C5 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C1'-O4'-C4' 110.81 0.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . 0.405 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 C5'-C4'-O4' 108.712 -0.43 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.891 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 N19-C1'-C2' 115.15 0.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.869 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 O4'-C1'-C2' 106.696 0.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.869 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.434 -0.392 0 C4'-C3'-C2' 104.182 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C4'-C3' 106.211 0.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.502 ' OP1' ' CB ' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 C3'-C2'-C1' 104.927 1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.474 ' C7 ' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C3'-C2'-C1' 104.53 1.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.411 -0.714 0 C4'-C3'-C2' 105.061 1.861 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.556 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.412 -0.604 0 C3'-C2'-C1' 106.151 2.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.556 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 O4'-C1'-C2' 107.265 1.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.481 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.021 0 C1'-O4'-C4' 107.341 -1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.467 ' C8 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 C1'-O4'-C4' 110.634 0.667 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.467 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 103.824 0.624 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.43 ' C6 ' ' N3 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 101.966 -0.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 111.525 0.195 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.589 ' HE3' ' HA ' ' B' ' 109' ' ' VAL . 1.7 mmmt 65.31 -158.82 0.28 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.824 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 2.8 tp60 -135.79 138.6 42.77 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.186 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.752 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 8.1 ttm-85 -81.6 98.07 8.17 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.648 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.712 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -97.65 109.62 23.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.753 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.702 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.4 OUTLIER -116.95 121.59 41.86 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.921 -177.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.65 ' CG1' HG12 ' A' ' 9' ' ' VAL . 0.8 OUTLIER -98.96 102.55 13.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 176.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.628 HG23 ' HG3' ' B' ' 104' ' ' ARG . 5.9 p -70.15 67.38 0.3 Allowed 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.804 HG13 ' HB3' ' A' ' 14' ' ' TYR . 13.4 p -97.95 -101.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.687 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.3 OUTLIER 70.91 -61.68 0.47 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 104.195 -2.52 . . . . 0.0 104.195 -174.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -36.58 -70.22 0.1 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 112.83 -1.987 . . . . 0.0 108.804 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.752 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -63.62 -61.54 2.25 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 -175.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.505 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 171.7 37.31 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 120.186 1.357 . . . . 0.0 113.347 -179.328 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.804 ' HB3' HG13 ' A' ' 9' ' ' VAL . 1.2 t80 -81.32 -50.5 9.43 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.44 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.1 mm-40 -49.88 -30.12 9.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -176.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.429 ' CD2' ' OH ' ' A' ' 20' ' ' TYR . 1.8 mt -55.5 -59.06 5.36 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.074 0.397 . . . . 0.0 111.306 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.757 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -55.17 -51.26 67.09 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.546 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -72.25 -25.95 61.82 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.234 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.45 ' CB ' ' O ' ' A' ' 15' ' ' GLN . . . -58.39 -28.87 65.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.433 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.708 ' CE2' ' CD1' ' B' ' 139' ' ' LEU . 6.4 m-30 -88.09 -42.2 12.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.596 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 149.21 1.82 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 O-C-N 124.294 0.997 . . . . 0.0 112.347 178.455 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.565 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 16.5 t -94.05 71.46 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 121.938 -0.476 . . . . 0.0 112.12 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -61.43 47.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.71 ' CG2' ' HE1' ' B' ' 132' ' ' MET . 0.5 OUTLIER 40.33 -4.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 178.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.577 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 0.7 OUTLIER -40.86 -55.97 2.33 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 120.066 1.303 . . . . 0.0 110.973 -178.707 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -28.1 24.45 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.499 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.68 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -63.45 -64.33 0.93 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 117.325 0.562 . . . . 0.0 110.143 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.664 HG22 ' CG2' ' A' ' 24' ' ' ILE . 2.7 t -51.3 -61.22 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.656 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 9.3 p -48.68 -27.24 2.74 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.134 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.2 m -83.25 -53.28 5.88 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.438 ' HB ' HD23 ' B' ' 127' ' ' LEU . 10.2 m -55.33 -50.82 68.64 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.642 0.734 . . . . 0.0 109.201 178.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.802 ' HA ' ' HG ' ' B' ' 117' ' ' LEU . 5.3 mmt -48.89 -50.08 36.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.526 -1.216 . . . . 0.0 111.955 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.476 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.93 -47.26 85.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.499 0.19 . . . . 0.0 110.922 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.476 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 72.4 m-20 -58.16 -53.97 52.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.765 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.479 ' HB3' HD21 ' B' ' 117' ' ' LEU . 27.6 mm-40 -69.25 -30.92 69.15 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.399 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.63 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -68.34 -30.64 69.66 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.241 0.543 . . . . 0.0 109.668 177.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.402 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 3.0 mmt180 -82.4 -52.15 7.17 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.922 0.867 . . . . 0.0 110.104 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.44 ' NE ' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -70.71 -18.69 62.8 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.593 -1.639 . . . . 0.0 114.007 -176.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.628 HD22 ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER -40.05 140.76 0.54 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 118.421 0.555 . . . . 0.0 111.947 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 40' ' ' ARG . 6.0 tpt180 75.33 -37.49 0.34 Allowed 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 168.18 13.51 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 111.834 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.44 ' O ' ' NE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -68.23 -167.89 0.1 Allowed 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.258 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' A' ' 43' ' ' ARG . 8.3 tpt180 -104.45 121.62 43.82 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.39 . . . . 0.0 112.0 -179.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -129.78 68.03 1.44 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.952 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.87 161.36 38.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.885 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.7 p -179.42 139.85 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.966 0.412 . . . . 0.0 111.8 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -132.99 140.59 47.84 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.166 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -179.59 -154.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.129 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 48' ' ' ASN . 1.4 mp0 75.98 108.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.92 0.391 . . . . 0.0 111.157 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -131.45 122.08 25.64 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -176.32 -148.5 7.04 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.903 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -124.53 -102.22 0.38 Allowed 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.251 0.093 . . . . 0.0 111.251 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 t 63.59 84.95 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.074 0.464 . . . . 0.0 111.126 -179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.661 ' HA ' ' CD2' ' A' ' 72' ' ' TRP . 8.9 pt-20 -74.08 123.87 25.22 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.441 0.638 . . . . 0.0 112.321 -179.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -150.55 44.31 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.744 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.53 77.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.879 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -111.59 -68.69 0.91 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.1 p90 176.52 159.66 0.33 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.189 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.0 tt -177.22 -53.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.524 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -132.02 145.22 51.32 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.465 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.34 55.95 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 0.0 111.011 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -127.38 -175.58 3.49 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.856 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 86.04 104.07 0.74 Allowed Glycine 0 C--N 1.335 0.499 0 C-N-CA 121.101 -0.571 . . . . 0.0 112.303 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.55 -49.41 11.36 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.584 0.192 . . . . 0.0 111.365 -179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -165.72 -61.14 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.32 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.8 56.74 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.898 0.38 . . . . 0.0 110.998 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.471 ' HB3' HD21 ' B' ' 139' ' ' LEU . 19.9 p-10 -100.08 149.15 23.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.915 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 42.98 63.43 1.49 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.403 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.75 60.24 0.16 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.21 0.529 . . . . 0.0 111.437 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.39 -78.23 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.846 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.9 t0 57.19 -176.32 0.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 120.993 0.425 . . . . 0.0 111.849 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.661 ' CD2' ' HA ' ' A' ' 54' ' ' GLU . 6.2 m0 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.033 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.624 ' C ' ' HG2' ' B' ' 102' ' ' LYS . 3.0 mtm . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.615 0.245 . . . . 0.0 111.528 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.624 ' HG2' ' C ' ' B' ' 101' ' ' MET . 0.0 OUTLIER -156.53 170.05 23.25 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.74 179.82 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.687 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 9.8 tt0 -135.45 134.64 39.81 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.628 ' HG3' HG23 ' A' ' 8' ' ' THR . 8.6 ttm105 -79.56 116.19 19.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.287 0.565 . . . . 0.0 110.033 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.793 ' HB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -115.4 116.37 52.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.405 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.702 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -121.05 127.16 51.44 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -175.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.538 ' CG2' ' O ' ' B' ' 107' ' ' VAL . 0.5 OUTLIER -103.73 95.64 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.752 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 52.8 p -70.9 91.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.938 -1.101 . . . . 0.0 109.93 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.773 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 4.4 m -132.4 -30.17 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -177.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.824 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 7.9 t70 42.38 -88.1 0.01 OUTLIER 'General case' 0 C--N 1.343 0.302 0 CA-C-O 122.451 1.12 . . . . 0.0 108.721 -177.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.577 ' N ' ' O ' ' B' ' 109' ' ' VAL . 2.0 m -60.81 -18.31 54.66 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 112.542 -2.117 . . . . 0.0 114.991 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.773 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -79.5 62.3 3.78 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 120.194 1.361 . . . . 0.0 110.374 -178.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 29' ' ' SER . 17.0 m 57.98 -19.73 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.712 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -47.08 -54.24 10.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.496 0.665 . . . . 0.0 110.663 179.301 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.616 ' HG2' ' O ' ' B' ' 110' ' ' ASP . 3.7 pt20 -50.18 -43.85 52.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.717 -1.128 . . . . 0.0 112.614 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.63 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -56.56 -45.16 81.41 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 120.874 0.369 . . . . 0.0 111.864 -179.476 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.802 ' HG ' ' HA ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -55.14 -47.62 74.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.725 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -79.25 -33.14 43.8 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.205 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.434 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -57.91 -31.15 66.51 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.914 178.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.638 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.67 -43.33 11.4 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.447 178.976 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.638 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 151.55 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 177.026 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.555 ' O ' ' HB3' ' B' ' 117' ' ' LEU . 88.6 t -162.07 88.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.725 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -61.93 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.716 HG23 ' HE3' ' A' ' 32' ' ' MET . 0.1 OUTLIER -151.12 -0.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 178.453 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 8.7 t -38.71 -62.39 0.62 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.69 0.281 . . . . 0.0 110.63 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.99 -28.62 30.77 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.356 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.694 ' CD1' ' SD ' ' A' ' 32' ' ' MET . 1.2 tt -62.61 -61.91 2.1 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.845 0.322 . . . . 0.0 110.902 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.623 ' O ' ' HG2' ' B' ' 132' ' ' MET . 3.9 t -53.09 -61.35 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.822 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.752 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 16.1 p -49.56 -45.58 47.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.5 OUTLIER -83.57 -50.68 8.0 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.806 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.667 ' HB ' HD21 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -54.47 -34.52 61.71 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.757 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.6 mmt -66.55 -52.52 44.78 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.054 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -42.06 61.35 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 122.143 -0.348 . . . . 0.0 111.191 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.3 m-20 -64.38 -55.68 19.42 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.858 0.361 . . . . 0.0 110.173 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.548 ' O ' ' N ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER -67.25 -23.06 65.65 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.693 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -72.07 -40.14 68.5 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -52.85 14.12 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.842 0.83 . . . . 0.0 109.521 177.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -45.35 53.9 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.027 -177.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.708 ' CD1' ' CE2' ' A' ' 20' ' ' TYR . 74.8 mt 35.66 56.77 0.92 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.089 0.956 . . . . 0.0 112.337 -178.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' B' ' 139' ' ' LEU . 19.9 mtm180 -161.05 151.5 17.93 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.239 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.83 134.99 57.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.611 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.78 148.31 31.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.371 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -103.27 132.56 49.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.4 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 33.1 p90 -85.05 149.29 25.67 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.918 0.39 . . . . 0.0 111.533 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.503 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER 51.87 59.64 4.41 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.958 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 10.2 m -82.97 -169.71 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.5 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.35 161.94 29.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.894 0.378 . . . . 0.0 111.544 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -178.71 175.57 1.06 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.946 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.27 119.54 7.3 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.718 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 63.29 -136.5 0.38 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.553 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 172.39 159.17 18.3 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.903 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' MET . . . . . 0.411 ' O ' ' HB ' ' B' ' 153' ' ' VAL . 13.9 ptp -106.89 -17.19 14.27 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' B' ' 152' ' ' MET . 40.6 t 76.48 139.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.951 0.405 . . . . 0.0 111.2 -179.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.498 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . 0.5 OUTLIER -70.97 -50.62 32.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.804 -179.826 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.493 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 12.8 t 65.11 -0.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 49.6 81.51 0.06 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.054 0.454 . . . . 0.0 111.592 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -68.83 78.52 0.31 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.419 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 0.1 OUTLIER 66.77 -147.53 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.657 179.209 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.419 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 70.0 mt 72.5 -56.37 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 122.615 0.366 . . . . 0.0 111.945 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' B' ' 159' ' ' ILE . 1.1 tt0 83.99 166.85 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.833 0.453 . . . . 0.0 111.086 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -146.83 134.29 20.83 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.252 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -109.41 64.2 0.61 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.084 0.468 . . . . 0.0 111.039 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -113.5 178.34 18.46 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.943 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 6.7 m -176.15 131.51 0.23 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.324 0.249 . . . . 0.0 110.557 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.486 ' CB ' HG23 ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.97 173.27 7.06 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.19 -179.094 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -83.96 -88.02 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.321 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.05 86.09 0.25 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.0 0.428 . . . . 0.0 110.949 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.57 179.75 7.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.944 -179.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -112.39 39.42 2.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.442 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.25 -165.78 0.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.608 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -78.58 -141.14 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.178 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' B' ' 154' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.247 0 CA-C-O 118.779 -0.629 . . . . 0.0 111.299 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.891 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.527 0.915 0 C3'-C2'-C1' 105.817 2.226 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.756 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.631 0 C3'-C2'-C1' 105.914 2.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.74 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.526 0 O4'-C1'-C2' 107.14 0.945 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.405 ' H71' " H2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C4'-C3'-C2' 104.716 1.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.539 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.933 0 C4'-C3'-C2' 104.731 1.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.539 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.645 0 C4'-C3'-C2' 103.961 0.761 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.468 ' C2 ' ' C2 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 105.237 1.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.468 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 105.244 -0.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.425 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 C3'-C2'-C1' 104.135 1.025 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.522 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -1.009 0 C3'-C2'-C1' 105.037 1.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.597 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 C1'-O4'-C4' 110.56 0.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.597 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 N19-C1'-C2' 115.238 0.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 C1'-O4'-C4' 110.491 0.565 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.862 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 N19-C1'-C2' 115.202 0.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.822 H5'' " O5'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-C2' 107.028 0.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 C3'-C2'-C1' 102.051 -0.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.601 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 O4'-C1'-C2' 106.993 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.577 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.905 0 C4'-C3'-C2' 104.787 1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.518 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.525 0.691 0 C3'-C2'-C1' 105.26 1.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.475 " O5'" H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C3'-C2'-C1' 104.332 1.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.489 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.409 -0.837 0 C4'-C3'-C2' 104.785 1.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.476 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C1'-O4'-C4' 110.78 0.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.476 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.982 0 C1'-O4'-C4' 106.894 -2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.433 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.69 0 O4'-C1'-C2' 107.316 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.433 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.686 0 C4'-C3'-C2' 104.436 1.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.406 ' C6 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 101.587 -0.795 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.737 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 17.9 mmtm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 121.002 0.43 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.504 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 56.0 tt0 -112.35 120.4 41.56 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.205 0.526 . . . . 0.0 111.858 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.017 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -77.9 109.1 11.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.999 0.904 . . . . 0.0 111.798 -179.013 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.823 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -110.65 117.16 54.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.379 178.514 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.876 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -133.1 134.37 44.17 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 118.262 -1.375 . . . . 0.0 114.48 -177.735 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.874 HG12 HD13 ' B' ' 124' ' ' ILE . 1.4 m -99.72 111.68 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.969 HG23 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -71.6 67.85 0.56 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.013 -0.43 . . . . 0.0 111.975 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.806 HG22 HG22 ' A' ' 7' ' ' VAL . 3.2 m -99.03 -120.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.721 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.687 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 6.1 t70 157.61 -85.09 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.721 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -102.04 12.36 36.97 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 119.237 -0.411 . . . . 0.0 112.094 178.175 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.537 ' C ' ' H ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -73.43 60.39 0.63 Allowed 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.355 0.98 . . . . 0.0 108.47 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.558 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 48.8 m 61.52 -23.54 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.737 ' CG ' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -48.5 -60.63 2.53 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 123.173 0.589 . . . . 0.0 111.07 179.722 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.721 ' HG2' ' HA ' ' A' ' 11' ' ' SER . 0.8 OUTLIER -48.95 -36.94 18.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.804 -176.912 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.57 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.34 -49.52 77.5 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.915 ' CD1' HD22 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -51.57 -56.33 14.11 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.417 0.627 . . . . 0.0 111.653 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 4.7 pttt -70.43 -28.38 64.99 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.72 -26.0 68.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.677 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.871 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.76 -41.18 13.48 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.98 178.922 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.558 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 157.18 35.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 177.845 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.597 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -167.56 96.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 122.149 0.975 . . . . 0.0 113.527 -179.599 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.968 ' O ' HD12 ' A' ' 24' ' ' ILE . 34.1 m-80 -67.26 66.23 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.134 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.968 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER 36.34 -6.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -38.36 -61.74 0.66 Allowed 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.569 1.077 . . . . 0.0 111.559 -177.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.83 -33.27 34.2 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.294 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.948 HD23 ' CG2' ' A' ' 24' ' ' ILE . 22.4 tp -62.36 -61.97 2.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 117.367 0.584 . . . . 0.0 111.707 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.794 HG23 ' CG2' ' A' ' 24' ' ' ILE . 17.6 t -46.15 -68.54 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 O-C-N 123.381 0.425 . . . . 0.0 110.204 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.583 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 2.9 m -49.96 -37.01 30.2 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -64.13 -51.41 64.06 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.2 m -60.99 -39.85 91.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.057 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.847 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 6.0 mmt -58.41 -57.77 11.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.817 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.417 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -52.79 -35.4 56.69 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.998 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -70.65 -55.87 7.75 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.61 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.962 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -69.75 -17.53 63.44 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 177.68 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -75.83 -50.54 14.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -56.49 10.03 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.12 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.872 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.47 -179.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp . . . . . 0 N--CA 1.465 0.325 0 N-CA-C 110.486 -0.19 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.687 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 4.9 tt0 -113.59 116.51 29.62 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.278 0.561 . . . . 0.0 111.753 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.969 ' CZ ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -79.07 113.92 17.6 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.653 178.34 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.737 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -106.05 122.65 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.755 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.876 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -125.45 123.78 39.99 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.469 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.823 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.8 104.1 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 173.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 108' ' ' THR . . . . . 1.017 HG22 ' HG3' ' A' ' 4' ' ' ARG . 55.2 p -70.24 89.79 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.826 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.5 t -82.75 -131.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.0 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.737 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 22.3 t0 86.34 -3.39 0.73 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -175.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.5 m -137.04 -59.27 0.7 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.514 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.583 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -46.15 -91.6 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.954 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.5 OUTLIER 179.11 36.53 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.528 -0.733 . . . . 0.0 110.63 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.936 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -82.24 -46.16 14.07 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -178.756 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.562 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.82 -34.73 12.97 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.772 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -59.85 -56.93 15.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.424 0.556 . . . . 0.0 112.288 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.962 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -53.46 -40.61 65.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 119.856 -0.737 . . . . 0.0 111.495 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.659 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -79.15 -26.89 42.72 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 0.0 110.196 178.29 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -62.03 -29.82 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.738 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.705 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -88.0 -44.07 11.27 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.708 178.428 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.705 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 t0 160.21 15.82 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 177.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.469 ' O ' HD23 ' B' ' 117' ' ' LEU . 60.9 t -154.28 93.35 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-N 118.848 0.749 . . . . 0.0 112.938 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.606 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.3 m120 -56.58 -97.64 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.73 -1.28 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.9 OUTLIER -39.27 -64.47 0.46 Allowed 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.202 -177.823 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.22 -26.63 35.99 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 121.1 -0.572 . . . . 0.0 112.449 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.728 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.79 -61.09 2.75 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.065 0.46 . . . . 0.0 110.641 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.19 HG13 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -49.03 -66.38 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.965 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.584 ' N ' HG12 ' B' ' 128' ' ' VAL . 94.9 p -49.27 -35.22 17.23 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 29.0 m -70.76 -53.72 14.43 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.447 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -62.55 -41.0 98.61 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.111 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.19 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -56.72 -51.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.325 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.558 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -55.81 -39.3 71.16 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 121.024 -0.271 . . . . 0.0 111.09 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -47.46 65.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.99 -27.82 68.42 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.025 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.57 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -74.13 -52.33 12.88 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 122.919 0.487 . . . . 0.0 110.607 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.482 ' HA ' ' HD2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -54.16 -50.49 66.87 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.417 0.627 . . . . 0.0 110.724 178.908 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.457 ' CZ ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.77 0 CA-C-N 114.964 -1.016 . . . . 0.0 112.561 -177.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.357 0 CA-C-O 121.111 0.482 . . . . 0.0 111.71 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.615 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 34.4 tp60 -111.36 119.48 38.99 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.742 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.919 ' HG3' HG22 ' B' ' 108' ' ' THR . 9.0 ttp-105 -78.17 107.92 11.1 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.327 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.793 HD11 HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -109.33 116.47 52.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.128 178.788 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -121.51 124.03 43.43 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 119.8 -0.76 . . . . 0.0 112.921 -177.414 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.792 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.69 108.44 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.688 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.494 ' HB ' ' CG ' ' B' ' 102' ' ' LYS . 11.4 p -70.5 88.73 0.68 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.156 0.503 . . . . 0.0 110.54 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.148 HG21 ' CD1' ' A' ' 14' ' ' TYR . 15.8 m -81.9 -146.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.852 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.692 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 4.3 t70 87.82 -10.97 0.52 Allowed 'General case' 0 C--N 1.353 0.721 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -176.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 t -116.53 -69.84 0.83 Allowed 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.373 177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -51.68 -86.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.664 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.645 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 0.4 OUTLIER 178.77 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 120.416 1.462 . . . . 0.0 112.997 -178.955 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.148 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -82.96 -41.06 19.25 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.33 0.652 . . . . 0.0 112.615 179.429 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 1.5 mp0 -49.11 -42.91 40.74 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -175.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.717 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -55.26 -42.71 73.86 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.469 1.031 . . . . 0.0 112.445 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.949 HD12 ' HG2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -63.37 -55.12 27.08 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.108 -179.079 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -67.77 -26.0 65.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.495 0.664 . . . . 0.0 110.015 178.442 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -61.45 -31.77 71.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.594 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.579 ' CE2' HD22 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.5 -42.52 12.05 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 118.396 -0.811 . . . . 0.0 109.995 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 152.88 26.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.499 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.421 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.3 t -156.43 91.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 O-C-N 122.106 -0.371 . . . . 0.0 111.904 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -54.78 -92.01 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.952 HG21 HG22 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -153.84 1.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 115.874 1.805 . . . . 0.0 115.874 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.844 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.3 p -38.97 -63.72 0.51 Allowed 'General case' 0 C--O 1.246 0.915 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.236 -177.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.86 -23.39 52.89 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.443 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.943 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -65.12 -60.88 2.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.825 0.313 . . . . 0.0 111.111 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.812 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.7 t -50.44 -65.28 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.401 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.651 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 12.9 p -48.62 -36.1 15.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.3 m -78.04 -52.28 9.02 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.667 HG23 HD21 ' B' ' 127' ' ' LEU . 0.7 OUTLIER -60.51 -41.15 93.75 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.605 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.795 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.2 mmt -54.87 -47.02 74.76 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.526 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.4 tt0 -60.46 -52.6 64.5 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.7 0.286 . . . . 0.0 110.805 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -48.1 76.41 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.014 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.586 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -69.8 -33.07 71.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.147 178.02 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.686 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -64.56 -45.71 85.89 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.513 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -62.26 -51.33 68.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.332 177.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? . . . . . 0 N--CA 1.448 -0.546 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.429 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.505 ' HB3' HG23 ' A' ' 9' ' ' VAL . 24.9 tt0 -98.67 114.11 26.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.651 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.463 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 14.7 ttm-85 -78.29 105.35 9.47 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.401 0.619 . . . . 0.0 112.233 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.792 HG12 HG13 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -106.63 126.4 62.47 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 176.293 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.694 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -124.44 127.81 48.07 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 119.94 -0.704 . . . . 0.0 112.154 -177.72 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.844 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.2 t -100.14 93.85 3.2 Favored 'Isoleucine or valine' 0 C--N 1.346 0.44 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.919 HG22 ' HG3' ' A' ' 4' ' ' ARG . 73.3 p -70.62 66.87 0.35 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.811 0.815 . . . . 0.0 109.434 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.754 HG12 HG12 ' B' ' 107' ' ' VAL . 7.5 p -90.55 -124.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 CA-C-N 113.905 -1.498 . . . . 0.0 108.816 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.646 ' H ' HG22 ' B' ' 109' ' ' VAL . 21.7 t70 158.41 -92.22 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.652 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 26.5 t -97.61 9.57 42.16 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.226 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.71 ' HB2' ' CG2' ' B' ' 109' ' ' VAL . 52.8 m-20 -80.37 68.91 6.7 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 117.794 -1.563 . . . . 0.0 108.242 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.758 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 61.97 -24.3 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.167 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.643 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -48.69 -62.36 1.55 Allowed 'General case' 0 C--N 1.348 0.506 0 CA-C-O 120.895 0.379 . . . . 0.0 111.313 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.652 ' HG2' ' HA ' ' B' ' 111' ' ' SER . 0.8 OUTLIER -49.85 -34.56 20.26 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.134 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.686 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -59.75 -56.1 26.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.832 HD21 HD13 ' B' ' 127' ' ' LEU . 0.1 OUTLIER -54.04 -44.46 71.05 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 120.412 -0.515 . . . . 0.0 112.226 -177.963 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.712 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER -70.57 -25.66 63.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 178.664 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.576 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -63.88 -28.02 69.56 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.02 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.804 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -88.35 -41.4 12.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.749 -1.119 . . . . 0.0 110.715 178.726 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.641 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 m-20 146.42 45.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.429 ' HB ' HD23 ' B' ' 117' ' ' LEU . 25.7 t -150.9 -43.85 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.712 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 5.2 m-80 73.06 -121.09 0.05 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.143 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -138.3 0.26 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 C-N-CA 119.515 -0.874 . . . . 0.0 113.308 177.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.438 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.65 -63.14 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.094 0.473 . . . . 0.0 109.784 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.636 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -88.21 -33.98 10.13 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.329 178.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.832 HD13 HD21 ' B' ' 117' ' ' LEU . 9.1 tp -54.65 -62.35 1.71 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 117.149 0.475 . . . . 0.0 111.168 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.143 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.9 t -52.07 -62.34 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.313 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 20.9 p -52.46 -44.31 65.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.636 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -73.22 -49.14 29.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' B' ' 135' ' ' GLU . 2.8 m -53.72 -52.25 60.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.963 ' SD ' HG13 ' B' ' 128' ' ' VAL . 8.9 mtt -55.37 -53.77 51.98 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -52.58 -42.59 64.65 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.443 179.519 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -65.64 -54.45 27.48 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' B' ' 131' ' ' THR . 6.7 mm-40 -60.65 -28.05 68.28 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.717 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -76.02 -50.91 13.51 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.602 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -49.16 62.51 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.964 0.888 . . . . 0.0 109.529 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 . . . . . 0 N--CA 1.443 -0.803 0 CA-C-N 113.579 -1.646 . . . . 0.0 113.412 -178.122 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 120.463 0.173 . . . . 0.0 110.905 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.53 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.2 OUTLIER -123.93 102.12 7.61 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.405 0.622 . . . . 0.0 111.526 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.854 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.9 ttm105 -79.55 111.32 15.7 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.546 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.873 HG21 ' CD2' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -110.26 122.79 65.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.199 179.464 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.698 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.63 131.93 43.61 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.406 -0.918 . . . . 0.0 112.687 -177.788 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.993 HG22 HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.19 112.17 31.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.053 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.509 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 7.0 p -70.85 81.56 0.64 Allowed 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.923 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.101 HG21 ' CD2' ' A' ' 14' ' ' TYR . 7.0 m -77.39 -137.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.156 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.704 ' HB2' ' HB2' ' B' ' 103' ' ' GLN . 36.9 t70 84.88 -11.47 0.78 Allowed 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -122.13 -63.11 1.32 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.187 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.652 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 0.8 OUTLIER -48.16 -97.94 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.197 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.601 ' O ' ' HB2' ' B' ' 132' ' ' MET . 4.0 m -174.23 41.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.144 -0.972 . . . . 0.0 111.814 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.101 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -80.6 -41.59 23.7 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.0 -46.36 43.78 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -175.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -53.55 -44.82 69.55 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.574 0.625 . . . . 0.0 112.237 -179.351 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.085 HD23 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -63.5 -48.28 78.25 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.444 0.64 . . . . 0.0 111.626 -179.826 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -76.93 -29.97 55.9 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.145 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.44 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.06 -29.71 70.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.764 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 1.085 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.82 -43.71 11.03 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.61 179.012 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 155.51 37.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.863 ' HB ' HD22 ' A' ' 17' ' ' LEU . 47.6 t -150.82 86.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 121.115 -0.991 . . . . 0.0 113.062 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.976 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -76.59 54.38 0.95 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.164 0.506 . . . . 0.0 111.069 179.081 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.011 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.7 OUTLIER 39.55 -4.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 119.339 3.089 . . . . 0.0 119.339 178.928 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.472 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -38.69 -63.88 0.48 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 120.267 1.394 . . . . 0.0 110.578 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.511 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.35 -33.38 11.81 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.923 -0.655 . . . . 0.0 111.862 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.682 ' CD1' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -52.61 -61.64 2.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.919 0.39 . . . . 0.0 110.764 178.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.011 HG23 ' CG2' ' A' ' 24' ' ' ILE . 0.9 OUTLIER -53.18 -66.31 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.862 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.655 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 18.5 m -50.97 -41.74 59.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.46 -54.33 11.0 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.776 HG21 HG21 ' B' ' 131' ' ' THR . 17.1 m -54.12 -39.3 66.31 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.78 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.035 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.46 -51.31 58.13 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.178 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.549 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -48.6 -33.37 9.67 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.992 0.814 . . . . 0.0 110.16 179.69 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.3 -57.18 9.07 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HB2' HD21 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -77.86 -10.34 59.51 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.603 178.537 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.929 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.49 -28.95 20.49 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.11 -54.0 5.64 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.641 0.734 . . . . 0.0 109.708 179.066 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.794 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.188 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.509 ' HD3' ' O ' ' A' ' 8' ' ' THR . 4.3 mmtm . . . . . 0 N--CA 1.463 0.208 0 CA-C-O 120.56 0.219 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.744 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -94.87 113.58 25.33 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.0 0.428 . . . . 0.0 112.012 -179.473 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.61 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.46 97.81 7.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.942 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.768 HD13 ' CD1' ' A' ' 14' ' ' TYR . 8.9 pt -100.04 113.77 36.51 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.958 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.698 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -117.98 119.32 34.43 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.571 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.19 102.78 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 174.082 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.854 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 14.3 p -67.97 89.8 0.3 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.909 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.97 HG21 ' CB ' ' B' ' 114' ' ' TYR . 5.8 t -80.97 -126.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.455 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.66 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 81.65 -10.65 1.14 Allowed 'General case' 0 C--N 1.351 0.648 0 CA-C-N 118.86 0.755 . . . . 0.0 109.188 -176.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.3 m -128.25 -61.88 1.07 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.001 177.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.655 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.18 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -178.374 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.446 ' HB3' ' O ' ' A' ' 29' ' ' SER . 9.6 t -179.57 41.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.185 0.902 . . . . 0.0 111.428 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.97 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.68 -50.22 8.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.748 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.523 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.61 -41.35 41.97 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.787 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.929 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -51.33 -56.43 13.11 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.539 0.609 . . . . 0.0 110.981 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.684 HD13 ' CE2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER -45.9 -52.68 11.08 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.809 0.814 . . . . 0.0 111.56 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 15.3 pttt -79.43 -30.3 42.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.768 -1.105 . . . . 0.0 111.877 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -66.52 -22.11 66.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.471 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.684 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.13 -41.99 12.65 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.167 178.592 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.656 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.1 t70 170.81 25.43 0.0 OUTLIER 'General case' 0 C--N 1.359 0.999 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.58 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.4 OUTLIER -170.29 107.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.064 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.86 ' O ' HD12 ' B' ' 124' ' ' ILE . 71.6 m-80 -66.8 50.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.732 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.035 HG21 ' CE ' ' A' ' 32' ' ' MET . 1.9 pp 34.89 2.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 119.409 3.115 . . . . 0.0 119.409 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.44 -62.04 0.63 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.294 0.497 . . . . 0.0 110.689 -178.209 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -77.62 -24.7 64.51 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.645 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.653 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.8 tm? -67.67 -57.11 6.96 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.999 0.4 . . . . 0.0 110.774 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.977 HG23 ' HB ' ' B' ' 124' ' ' ILE . 88.3 t -50.19 -73.17 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.895 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.795 ' HA ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.43 -33.89 15.2 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 19.8 m -68.81 -47.36 66.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.776 HG21 HG21 ' A' ' 31' ' ' THR . 89.5 m -59.06 -39.61 82.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.516 177.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.028 ' HA ' HD12 ' A' ' 17' ' ' LEU . 14.7 mmm -57.54 -57.38 12.93 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -59.34 -38.11 79.54 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.074 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -68.15 -46.74 69.96 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.879 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -71.2 -28.82 64.5 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.601 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.823 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.96 -25.67 43.51 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.304 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -82.54 -53.45 5.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.812 0.815 . . . . 0.0 110.487 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.777 0 CA-C-N 114.054 -1.43 . . . . 0.0 114.164 -177.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.0 ptpt . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 120.858 0.361 . . . . 0.0 111.617 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.622 ' O ' ' HA ' ' B' ' 108' ' ' THR . 34.5 tp60 -95.9 118.51 32.67 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.211 0.529 . . . . 0.0 110.997 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.969 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.84 105.82 9.28 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.698 0.761 . . . . 0.0 111.584 -178.553 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.72 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -108.99 111.51 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 177.809 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.66 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -116.49 128.38 55.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.517 -177.424 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.94 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -98.87 101.51 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 176.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.436 ' CG2' ' NH1' ' B' ' 104' ' ' ARG . 2.3 p -69.72 67.81 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.8 0.81 . . . . 0.0 109.272 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.982 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.4 p -79.9 -135.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.384 -178.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.785 ' H ' HG22 ' A' ' 9' ' ' VAL . 5.8 t70 91.2 -0.33 0.17 Allowed 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 119.591 1.087 . . . . 0.0 109.165 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.5 -55.98 0.69 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.673 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 0.6 OUTLIER -45.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 123.526 0.516 . . . . 0.0 111.579 -179.487 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.561 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 0.3 OUTLIER 176.59 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 119.176 0.898 . . . . 0.0 111.771 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.39 -43.15 16.21 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.8 mp0 -49.83 -39.99 40.68 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -176.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.816 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -57.28 -56.6 19.75 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.829 HD13 HD11 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -54.15 -47.35 72.05 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.021 -0.672 . . . . 0.0 112.268 -177.36 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.719 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 pttt -73.24 -25.76 60.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.301 0.572 . . . . 0.0 110.01 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.1 -28.61 69.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.052 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.32 -43.12 11.77 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.305 178.685 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.6 t70 163.84 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.725 ' HB ' HD23 ' A' ' 17' ' ' LEU . 47.6 t -137.89 89.06 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 119.624 1.102 . . . . 0.0 113.588 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.6 m-80 -68.93 61.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.946 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 45.41 -16.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 117.871 2.545 . . . . 0.0 117.871 -179.362 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 23' ' ' ASN . 7.8 t -37.61 -64.49 0.38 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.758 1.163 . . . . 0.0 112.013 -176.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.91 -22.45 57.72 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.829 HD11 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.81 -62.05 1.72 Allowed 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 122.728 0.411 . . . . 0.0 110.767 179.644 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.97 HG23 ' CG2' ' A' ' 24' ' ' ILE . 5.2 t -48.79 -63.01 0.4 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.98 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.684 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.825 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -48.44 -36.45 14.94 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 25.4 m -69.91 -52.66 22.76 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.615 HG21 ' HB ' ' B' ' 131' ' ' THR . 20.6 m -61.23 -39.24 89.55 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.86 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.885 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.7 mmt -60.06 -57.88 10.94 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.893 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.448 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 3.0 tt0 -57.16 -35.22 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -50.41 33.13 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.848 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.5 tp10 -72.96 -16.34 61.53 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.685 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -86.01 -47.95 9.12 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.815 0.446 . . . . 0.0 110.117 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 1.2 mmt180 -55.58 -52.03 65.12 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.57 0.7 . . . . 0.0 110.77 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 . . . . . 0 N--CA 1.445 -0.688 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.957 -178.214 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 36.4 tt0 -101.97 114.6 28.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.243 0.544 . . . . 0.0 109.975 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.498 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.9 ttm-85 -79.32 99.93 7.34 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.282 -177.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.65 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -108.1 110.31 31.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.66 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -107.15 122.19 46.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.863 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.72 HG13 HG12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.08 95.11 3.76 Favored 'Isoleucine or valine' 0 C--N 1.343 0.285 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.969 HG22 ' HG3' ' A' ' 4' ' ' ARG . 74.3 p -68.16 94.03 0.48 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.248 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.088 HG21 ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -80.9 -132.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.925 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.497 ' H ' HG12 ' B' ' 109' ' ' VAL . 19.9 t70 91.23 -12.53 0.24 Allowed 'General case' 0 C--N 1.351 0.637 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -129.66 -54.27 1.15 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.445 178.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.825 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.7 OUTLIER -48.72 -99.63 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -179.2 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.229 -0.92 . . . . 0.0 110.828 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.088 ' HB3' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.27 -39.14 21.23 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.944 1.091 . . . . 0.0 113.944 -179.062 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.3 -39.63 22.43 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -175.183 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.685 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -60.89 -56.68 18.27 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 1.105 HD22 HG11 ' B' ' 122' ' ' VAL . 1.5 mt -57.46 -38.19 74.09 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.318 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.63 ' HD3' ' OH ' ' B' ' 114' ' ' TYR . 0.8 OUTLIER -79.35 -31.23 42.96 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.155 0.503 . . . . 0.0 111.132 178.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.585 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.67 -28.92 67.69 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.364 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 1.072 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.28 -42.62 12.13 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 117.469 -1.253 . . . . 0.0 110.977 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.708 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 2.7 p30 151.35 12.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 1.105 HG11 HD22 ' B' ' 117' ' ' LEU . 1.4 p -89.83 -31.17 5.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 118.882 0.764 . . . . 0.0 112.886 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.008 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m-80 36.04 41.12 0.12 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.028 0.531 . . . . 0.0 111.621 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.008 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.5 OUTLIER 43.74 -8.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 N-CA-C 118.494 2.775 . . . . 0.0 118.494 179.438 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.94 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.87 -63.29 0.54 Allowed 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.114 1.324 . . . . 0.0 110.026 -177.842 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.43 -23.19 54.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.024 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.686 ' CD1' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.72 -61.05 2.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.521 0.328 . . . . 0.0 111.209 179.892 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.844 HG23 ' CG2' ' B' ' 124' ' ' ILE . 17.2 t -50.13 -63.69 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.459 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 13.5 p -49.9 -43.83 49.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 23.5 m -68.87 -53.68 19.88 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.633 HG22 ' O ' ' B' ' 128' ' ' VAL . 2.1 t -56.14 -40.23 73.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.688 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.814 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -62.09 -57.75 10.4 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.282 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.561 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 1.3 tp60 -49.65 -40.9 41.22 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.038 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -69.56 -57.12 5.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.072 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.719 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -66.81 -14.73 62.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.333 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.14 -52.79 5.05 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.198 0.599 . . . . 0.0 111.689 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -54.96 -56.32 20.93 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.379 0.609 . . . . 0.0 111.825 -178.711 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.438 -1.066 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.095 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.991 0.424 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 108' ' ' THR . 29.3 tp60 -104.2 107.38 18.26 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.219 0.533 . . . . 0.0 110.235 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 5.6 ttm180 -78.19 102.87 7.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.72 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.0 ' CD1' HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -108.1 127.19 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 177.416 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.676 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -129.73 127.77 41.11 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.81 -0.756 . . . . 0.0 112.529 -176.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.709 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.57 109.06 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.363 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' B' ' 102' ' ' LYS . 5.8 p -70.56 94.31 0.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.083 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.026 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.8 t -84.6 -132.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.827 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.675 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 3.8 t70 82.63 -10.32 1.07 Allowed 'General case' 0 C--N 1.35 0.627 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.1 m -128.4 -58.18 1.19 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.204 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 1.3 m-20 -49.7 -101.96 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -177.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 36.02 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.558 -0.714 . . . . 0.0 110.701 -178.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.026 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.01 -39.15 23.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.303 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.12 -45.52 33.12 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -176.846 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.807 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -54.59 -47.32 73.49 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.943 0.792 . . . . 0.0 111.893 -179.615 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.848 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.82 -49.86 76.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.117 -179.461 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.5 OUTLIER -73.99 -26.06 60.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.299 178.581 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -65.38 -27.53 68.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.409 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.671 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.1 -42.19 12.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.468 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.6 21.34 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 176.287 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.6 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 61.7 t -156.71 94.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.597 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' ' HE1' ' B' ' 132' ' ' MET . 3.3 p30 -60.34 -93.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.079 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -148.61 3.08 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 179.072 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 24' ' ' ILE . 4.1 t -38.03 -63.17 0.5 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.662 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.05 -29.99 18.63 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.507 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.728 ' HB3' HG22 ' A' ' 24' ' ' ILE . 13.0 tp -56.52 -61.97 2.05 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 117.282 0.541 . . . . 0.0 110.718 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.079 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.1 t -54.66 -57.09 7.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-O 121.774 0.797 . . . . 0.0 109.097 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.85 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 60.2 m -47.38 -49.84 23.71 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.802 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.5 OUTLIER -80.75 -47.4 13.99 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.78 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.34 -43.83 92.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.69 -179.321 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.049 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.6 mmt -54.01 -57.11 12.26 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.319 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -54.86 -36.97 65.66 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -52.88 22.03 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.919 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.6 tp10 -70.78 -25.31 62.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.408 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.748 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -81.88 -25.22 35.21 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 122.839 0.456 . . . . 0.0 110.747 178.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -79.66 -46.99 16.14 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 122.095 0.95 . . . . 0.0 108.835 178.05 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.959 0 CA-C-N 113.233 -1.803 . . . . 0.0 113.172 -177.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 22.7 mmmt . . . . . 0 N--CA 1.466 0.36 0 CA-C-O 120.678 0.275 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.648 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -104.88 107.68 18.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.119 0.485 . . . . 0.0 111.014 179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.501 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.2 OUTLIER -78.59 106.97 10.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.856 0.836 . . . . 0.0 111.875 -178.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.754 HD11 HG11 ' B' ' 128' ' ' VAL . 1.4 pt -110.04 120.77 61.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.089 178.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.676 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.01 125.8 32.38 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -177.993 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 1.0 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.47 103.84 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.829 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 82.1 p -68.94 90.15 0.43 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.192 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.1 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.2 t -79.22 -134.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.296 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 35.3 t70 90.54 -5.74 0.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.711 0.767 . . . . 0.0 109.192 -176.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -134.61 -59.37 0.81 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.156 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.85 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 1.5 m-20 -47.98 -95.03 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.578 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 1.2 m -177.93 35.0 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.362 -0.836 . . . . 0.0 111.404 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.1 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -80.6 -43.97 19.7 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.645 0.778 . . . . 0.0 111.269 179.302 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.702 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 81.8 mt-30 -49.81 -38.29 34.01 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.68 -177.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.748 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -57.27 -56.52 20.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.528 0.603 . . . . 0.0 112.211 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 1.049 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -54.6 -40.07 68.51 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.733 -178.29 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.24 -32.3 43.79 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.458 0.647 . . . . 0.0 110.938 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.556 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -62.98 -28.88 70.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.611 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.662 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.3 OUTLIER -88.02 -46.28 9.47 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.661 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 3.2 t0 165.87 12.72 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.447 ' O ' HD22 ' B' ' 117' ' ' LEU . 72.7 t -153.69 91.99 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-N 118.783 0.719 . . . . 0.0 112.014 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.0 OUTLIER -59.3 -102.36 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.012 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.37 4.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 179.15 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.4 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -44.41 -64.03 0.77 Allowed 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.327 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.463 ' HA2' ' OG ' ' B' ' 129' ' ' SER . . . -86.1 -29.74 24.72 Favored Glycine 0 C--N 1.337 0.631 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.071 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.682 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.4 -61.38 2.37 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 122.342 0.257 . . . . 0.0 110.649 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.999 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -54.64 -61.88 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-O 121.347 0.594 . . . . 0.0 110.103 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.874 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 9.0 p -47.99 -44.05 30.32 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -78.65 -47.79 16.34 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.447 0.567 . . . . 0.0 109.972 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.433 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 3.2 m -60.13 -47.69 84.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.322 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.848 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 4.5 mmt -54.64 -53.63 52.28 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.484 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -49.39 -40.11 34.86 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -69.75 -48.99 57.37 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 121.367 -0.133 . . . . 0.0 110.911 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -74.66 -13.57 60.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.914 0.388 . . . . 0.0 110.214 178.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.807 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.75 -48.52 7.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -51.6 -54.53 26.69 Favored 'General case' 0 CA--C 1.5 -0.97 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.266 178.701 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.505 -178.662 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 120.581 0.229 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.661 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 4.2 tt0 -124.23 121.8 36.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.584 0.707 . . . . 0.0 111.771 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.889 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.7 ttp-105 -79.81 113.25 17.82 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.069 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.813 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -103.4 124.35 57.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.65 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.645 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -129.99 123.61 31.01 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.434 -0.906 . . . . 0.0 111.844 -177.723 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.877 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.67 108.46 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.9 p -70.9 89.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.04 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.1 t -86.41 -132.31 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 119.106 -0.473 . . . . 0.0 111.985 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.9 t70 82.4 -8.82 1.21 Allowed 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -175.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -130.1 -63.23 0.91 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.119 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.713 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.72 -89.84 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.772 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.9 t 176.53 39.55 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.705 0.764 . . . . 0.0 110.772 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.04 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.71 -44.25 14.67 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.877 -179.251 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.623 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -47.53 -37.9 13.04 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -175.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.81 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.83 -56.6 19.27 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.721 0.692 . . . . 0.0 112.458 -179.628 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.919 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.65 -43.87 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.457 0.646 . . . . 0.0 111.378 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.738 ' HB3' ' HB3' ' A' ' 23' ' ' ASN . 4.2 pttt -79.65 -30.95 41.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.605 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.34 -29.05 67.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.873 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.667 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.12 -46.55 9.2 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.463 178.459 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 154.83 19.72 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 176.125 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.657 ' O ' HD12 ' A' ' 17' ' ' LEU . 75.0 t -156.58 84.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 118.165 0.438 . . . . 0.0 111.678 -178.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.738 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -58.08 -96.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.872 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.067 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -138.98 -3.71 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 115.664 1.728 . . . . 0.0 115.664 -179.427 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 78.3 p -39.05 -64.23 0.47 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-N 119.057 0.844 . . . . 0.0 109.501 -179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.468 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -85.22 -29.99 26.46 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.65 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 4.9 tp -58.64 -61.98 2.2 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.875 0.338 . . . . 0.0 110.83 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.067 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.03 -67.25 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.65 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 90.9 p -48.45 -36.76 15.64 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -78.47 -45.93 20.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.556 0.616 . . . . 0.0 109.595 178.427 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.544 ' OG1' HG21 ' B' ' 131' ' ' THR . 20.9 m -64.0 -50.02 70.18 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.65 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.72 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 2.6 mmt -50.96 -43.13 60.33 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.849 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.448 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -61.21 -48.92 79.27 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.039 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -47.47 85.4 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.861 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -64.75 -38.63 91.64 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.57 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.598 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.11 -47.27 85.87 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -51.91 67.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 . . . . . 0 N--CA 1.449 -0.508 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.925 -179.551 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 9' ' ' VAL . 5.3 mmpt? . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 120.434 0.159 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 9' ' ' VAL . 26.9 tp60 -114.01 115.25 27.32 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.942 0.401 . . . . 0.0 111.887 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.428 ' HG3' ' NH1' ' B' ' 104' ' ' ARG . 5.9 ttm-85 -78.42 109.18 12.35 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.876 0.846 . . . . 0.0 111.773 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.81 HD11 HG11 ' B' ' 128' ' ' VAL . 0.8 OUTLIER -108.16 127.31 64.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 113.993 -1.458 . . . . 0.0 107.115 177.887 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.645 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.46 129.86 41.73 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -177.301 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.896 HG12 HD13 ' A' ' 24' ' ' ILE . 1.1 m -101.57 99.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 173.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.889 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -70.76 67.48 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.793 -0.763 . . . . 0.0 111.782 -177.695 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.851 HG22 HG22 ' B' ' 107' ' ' VAL . 3.8 m -99.67 -114.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 10.0 t0 145.74 -84.82 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -88.19 2.84 51.3 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.134 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.65 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -76.14 62.26 1.68 Allowed 'General case' 0 C--N 1.357 0.93 0 CA-C-N 119.588 1.085 . . . . 0.0 108.73 179.419 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.653 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 59.55 -25.58 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.755 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.813 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -44.49 -62.19 1.27 Allowed 'General case' 0 C--N 1.348 0.534 0 C-N-CA 123.352 0.661 . . . . 0.0 111.411 -179.648 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.576 ' N ' ' CG ' ' B' ' 114' ' ' TYR . 2.6 pp0? -49.45 -33.59 14.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.58 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.598 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -60.4 -50.18 74.61 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.861 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -52.53 -51.97 57.05 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.695 0.759 . . . . 0.0 111.557 -179.571 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.683 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -73.47 -29.02 62.26 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.193 179.556 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.54 -25.72 68.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.607 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.836 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -87.78 -41.0 13.59 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 118.608 -0.711 . . . . 0.0 109.804 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 158.68 39.04 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 177.057 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.635 HG13 ' O ' ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.1 94.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.885 ' O ' HD12 ' B' ' 124' ' ' ILE . 59.1 m-80 -67.3 71.01 0.11 Allowed 'General case' 0 N--CA 1.462 0.128 0 O-C-N 121.599 -0.688 . . . . 0.0 109.584 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.885 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.3 OUTLIER 37.59 -10.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.877 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.84 -55.99 1.14 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 120.002 1.274 . . . . 0.0 110.52 -176.764 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.547 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.16 -30.42 28.31 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.311 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.753 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.7 tm? -60.88 -61.26 2.71 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.952 0.376 . . . . 0.0 110.687 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.811 HG23 ' CG2' ' B' ' 124' ' ' ILE . 41.4 t -50.68 -64.19 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.713 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 24.7 p -50.42 -48.7 56.08 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -62.92 -50.92 68.94 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.544 HG21 ' OG1' ' A' ' 31' ' ' THR . 23.4 m -58.01 -42.69 85.78 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.06 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.919 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -59.19 -57.26 13.82 Favored 'General case' 0 C--O 1.209 -1.071 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.403 179.236 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.9 OUTLIER -49.1 -41.67 36.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.606 179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -51.91 54.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.602 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.864 ' HB3' HD21 ' A' ' 17' ' ' LEU . 8.9 tp10 -74.73 -14.57 60.74 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.684 0.278 . . . . 0.0 110.613 178.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.81 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.63 -38.02 16.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 123.211 0.604 . . . . 0.0 110.994 179.308 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -71.84 -53.45 13.24 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.835 0.826 . . . . 0.0 110.312 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.524 ' HA ' ' HD3' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.046 0 CA-C-N 113.969 -1.469 . . . . 0.0 113.62 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.594 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 20.7 mmtm . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.655 0.264 . . . . 0.0 110.746 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.654 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -112.85 114.54 27.11 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 120.927 0.394 . . . . 0.0 111.449 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.9 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.49 104.67 10.26 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.156 -0.618 . . . . 0.0 110.824 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.86 HD13 ' CD1' ' B' ' 114' ' ' TYR . 1.4 pt -109.41 127.92 65.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.869 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.9 141.74 48.54 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 117.955 -1.498 . . . . 0.0 113.316 -178.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 1.049 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.41 102.39 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.525 -1.216 . . . . 0.0 109.16 177.634 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.956 HG23 HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -70.18 76.92 0.52 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.815 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.2 p -110.67 -128.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.907 -176.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.808 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 5.3 t70 94.76 23.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 122.841 1.305 . . . . 0.0 109.399 -175.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 9' ' ' VAL . 12.3 t -150.24 -50.47 0.13 Allowed 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 112.746 -2.025 . . . . 0.0 110.486 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.715 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 5.6 m-20 -79.16 46.3 0.7 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.465 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 68.9 m 66.82 9.77 7.03 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.815 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -60.75 -50.74 72.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.969 1.258 . . . . 0.0 111.001 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 14.3 mm-40 -48.95 -32.46 9.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.382 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.735 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -64.81 -56.49 13.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.277 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.768 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.29 -56.08 8.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.275 0.559 . . . . 0.0 112.187 -178.306 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 15' ' ' GLN . 5.1 pttp -69.21 -25.98 64.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.491 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.13 -26.74 65.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.07 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.729 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.54 -38.57 15.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.725 -0.655 . . . . 0.0 109.664 178.812 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 156.69 25.04 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 177.156 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 24' ' ' ILE . 54.4 t -147.89 82.87 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 3.0 m-20 -64.65 63.79 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.939 0.4 . . . . 0.0 110.593 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.987 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 40.96 -13.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 23' ' ' ASN . 10.1 t -38.25 -61.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 119.862 1.21 . . . . 0.0 110.337 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -78.89 -36.13 29.38 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.031 178.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.546 HD13 HD11 ' A' ' 17' ' ' LEU . 7.9 tp -56.58 -61.87 2.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.766 0.317 . . . . 0.0 110.183 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.119 HG22 HG22 ' B' ' 128' ' ' VAL . 2.7 t -50.21 -64.52 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.176 178.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.685 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 26.5 p -49.36 -45.34 45.69 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -70.06 -42.94 72.17 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.583 HG21 ' OG1' ' B' ' 131' ' ' THR . 35.2 m -61.49 -42.78 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.038 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.853 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.4 mmt -50.27 -50.67 49.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.505 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.42 -45.15 95.52 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.145 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.505 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.74 -52.59 59.79 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.722 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 1.044 ' HG2' HD11 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -61.61 -37.1 82.7 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.154 178.714 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.852 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -66.23 -38.94 89.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.704 178.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -73.2 -56.1 5.56 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.397 0.618 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.89 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.183 -177.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 120.557 0.218 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.808 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 2.9 tt0 -122.49 119.88 32.24 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.076 0.465 . . . . 0.0 111.725 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.956 HH11 HG23 ' A' ' 8' ' ' THR . 9.9 ttt85 -79.64 117.95 21.02 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.795 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.831 HD11 HG11 ' B' ' 128' ' ' VAL . 0.5 OUTLIER -111.07 116.64 53.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.741 -179.656 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.869 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.11 126.06 54.21 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -176.26 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 107' ' ' VAL . 0.2 OUTLIER -100.86 85.78 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 175.425 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.9 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -56.03 98.39 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -179.655 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.998 HG11 ' CB ' ' B' ' 114' ' ' TYR . 14.9 p -110.36 -137.75 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.562 -175.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.747 ' H ' HG22 ' B' ' 109' ' ' VAL . 31.1 t70 89.14 -7.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -174.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.61 -65.51 1.14 Allowed 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.313 -1.312 . . . . 0.0 107.912 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.685 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -38.72 -84.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.244 0.34 . . . . 0.0 111.26 179.621 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.3 OUTLIER 173.9 45.86 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 121.123 0.487 . . . . 0.0 110.937 179.678 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.998 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.7 OUTLIER -83.35 -40.86 18.89 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.623 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.82 -40.59 21.54 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.707 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.852 HD22 ' HB1' ' A' ' 36' ' ' ALA . 1.4 mt -50.33 -33.48 20.38 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -78.4 -51.11 10.54 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.522 0.677 . . . . 0.0 111.648 178.705 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.623 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -70.46 -25.88 63.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.45 -27.85 50.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.019 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.542 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 2.8 m-30 -88.47 -40.75 13.23 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.303 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.3 t0 115.31 57.74 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.155 0.978 . . . . 0.0 111.547 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' B' ' 124' ' ' ILE . 92.0 t -118.34 -19.86 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.043 -179.019 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.612 ' O ' HD12 ' B' ' 124' ' ' ILE . 36.0 m-20 41.38 23.25 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.799 0.333 . . . . 0.0 111.562 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.874 HG22 HD22 ' B' ' 127' ' ' LEU . 2.4 pp 21.99 45.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 177.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.766 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 p -62.97 -63.72 1.12 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.813 176.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.443 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -81.15 -16.56 74.11 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.769 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 1.044 HD11 ' HG2' ' A' ' 35' ' ' GLU . 1.9 tp -66.82 -52.91 38.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.73 0.265 . . . . 0.0 111.235 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.119 HG22 HG22 ' A' ' 28' ' ' VAL . 35.0 t -53.57 -67.69 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.719 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.6 p -50.8 -36.64 38.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -63.06 -51.68 65.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.583 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.8 m -58.22 -31.73 67.63 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.081 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 14' ' ' TYR . 5.4 mmt -65.54 -54.71 24.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.482 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -49.94 -41.53 46.56 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.19 -54.0 44.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 116.833 -0.167 . . . . 0.0 110.749 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.1 mt-10 -75.08 -8.84 57.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.551 178.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -79.47 -47.31 15.85 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.224 -1.399 . . . . 0.0 107.224 176.079 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.9 74.54 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.398 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 . . . . . 0 CA--C 1.542 0.651 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.219 -178.582 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 121.093 0.473 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' B' ' 109' ' ' VAL . 1.2 tt0 -95.89 106.56 18.72 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.446 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.892 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.7 OUTLIER -78.87 99.86 6.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.738 -179.486 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.806 ' CG1' HD11 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -102.96 110.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 177.426 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.77 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.5 123.65 47.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 -175.645 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.647 HG22 ' CG2' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -100.16 105.66 17.96 Favored 'Isoleucine or valine' 0 C--N 1.344 0.337 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 176.286 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.0 p -70.08 90.46 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.028 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.1 t -78.08 -125.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.754 -177.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.585 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.6 t70 86.28 -5.34 0.76 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.292 0.568 . . . . 0.0 110.316 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.8 t -144.92 -52.0 0.28 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.335 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.794 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -44.78 -90.89 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.623 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' B' ' 129' ' ' SER . 1.6 m 177.85 34.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.392 -0.818 . . . . 0.0 111.133 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.028 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -84.05 -46.1 12.36 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.032 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.569 ' HA ' ' HG2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.12 -42.28 28.79 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.977 -176.931 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.89 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -60.29 -57.92 10.73 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.556 0.616 . . . . 0.0 111.82 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.093 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -60.34 -35.76 76.4 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.633 -178.377 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.784 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.74 -32.13 41.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.373 0.606 . . . . 0.0 112.117 -179.522 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.616 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -82.1 -16.88 48.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.267 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.737 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.98 -33.32 18.45 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.212 179.377 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.573 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 172.88 -19.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.871 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.784 ' O ' ' HA ' ' A' ' 18' ' ' LYS . 17.0 t -97.19 -179.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.255 0.55 . . . . 0.0 110.168 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.053 ' O ' HD12 ' A' ' 24' ' ' ILE . 20.8 m120 -160.67 43.94 0.19 Allowed 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 177.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.053 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.96 -4.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 113.022 -1.899 . . . . 0.0 115.921 -177.45 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.49 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.4 t -39.02 -63.79 0.5 Allowed 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.09 0.859 . . . . 0.0 109.675 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.587 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -86.76 -25.36 35.39 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.941 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.821 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -59.49 -62.36 1.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.438 0.619 . . . . 0.0 110.279 179.623 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.797 HG22 HG21 ' B' ' 124' ' ' ILE . 16.2 t -50.59 -59.26 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.787 0.804 . . . . 0.0 109.383 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 1.4 t -50.12 -52.58 33.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.0 OUTLIER -74.14 -50.96 17.12 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 117.762 0.255 . . . . 0.0 110.435 -177.89 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.579 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -54.17 -49.16 69.93 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.916 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.917 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 14.9 mtt -54.77 -48.16 73.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.189 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -45.35 73.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.413 0.149 . . . . 0.0 110.778 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -61.93 -57.1 13.03 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.7 OUTLIER -58.27 -33.61 69.6 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.692 178.449 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.626 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -70.41 -48.81 54.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.519 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -52.63 64.78 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.369 0.604 . . . . 0.0 111.135 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.698 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.918 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.547 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 18.4 mttm . . . . . 0 CA--C 1.534 0.364 0 CA-C-O 120.603 0.24 . . . . 0.0 111.637 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.585 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 43.5 tp60 -124.45 123.41 40.1 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.653 0.263 . . . . 0.0 110.99 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 5.8 ttm105 -85.92 116.45 24.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.354 0.597 . . . . 0.0 111.949 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.739 HD11 HG11 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -114.45 125.78 71.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 177.296 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.77 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.04 125.72 33.99 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.373 -0.531 . . . . 0.0 112.354 -176.728 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.62 HG12 ' CG2' ' B' ' 109' ' ' VAL . 0.9 OUTLIER -102.65 98.46 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 175.19 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.892 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.5 p -70.27 93.42 0.84 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.523 0.678 . . . . 0.0 110.816 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.098 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.9 t -85.55 -141.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.008 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.0 t0 91.01 -9.69 0.28 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 5.2 m -129.03 -56.63 1.18 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.196 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 1.2 m-20 -54.68 -104.19 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -167.14 29.24 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.018 -1.051 . . . . 0.0 111.661 -179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.098 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -72.73 -38.7 67.35 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.647 1.179 . . . . 0.0 112.864 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.642 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 6.6 mt-30 -48.99 -42.27 37.29 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -175.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.626 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -56.37 -34.55 66.76 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.35 0.977 . . . . 0.0 112.857 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.917 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -70.93 -52.36 20.42 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.97 0.414 . . . . 0.0 110.68 179.528 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.86 -25.69 66.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.446 0.641 . . . . 0.0 109.467 177.805 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.08 -33.25 75.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.957 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.707 ' CZ ' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.99 -29.03 21.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.925 -0.56 . . . . 0.0 110.446 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.0 t0 123.58 71.26 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.751 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -169.39 -40.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.506 ' O ' ' HE1' ' A' ' 32' ' ' MET . 14.8 m-80 64.47 -106.95 0.16 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.037 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.09 1.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 178.886 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.3 OUTLIER -39.47 -63.76 0.53 Allowed 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.721 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.462 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.38 -29.88 23.57 Favored Glycine 0 CA--C 1.522 0.515 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.945 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.702 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -56.88 -60.53 3.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.453 0.301 . . . . 0.0 110.813 179.187 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.037 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -53.55 -64.86 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.794 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 12.8 p -49.21 -43.96 42.84 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.8 m -72.18 -48.8 40.57 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.23 -36.87 85.07 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.025 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.093 ' HA ' HD12 ' A' ' 17' ' ' LEU . 3.7 mmt -64.42 -54.64 29.56 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.946 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.498 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -48.47 -35.67 13.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.806 -179.595 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -66.35 -57.26 7.83 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.774 ' CB ' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -73.08 -13.05 61.12 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.478 0.18 . . . . 0.0 111.189 178.626 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.89 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.84 -30.3 20.29 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 121.086 0.47 . . . . 0.0 109.807 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -82.29 -48.26 11.42 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.71 0.767 . . . . 0.0 110.686 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.674 0 CA-C-N 114.028 -1.442 . . . . 0.0 114.095 -177.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' B' ' 108' ' ' THR . 60.8 tp60 -108.79 111.15 22.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.311 0.577 . . . . 0.0 112.095 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.0 ttm-85 -79.36 103.6 9.4 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.64 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.811 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -98.1 130.34 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.066 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.076 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.794 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -131.32 130.07 42.27 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 117.799 -1.561 . . . . 0.0 114.191 -177.745 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 1.044 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -100.63 108.05 22.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.191 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.076 177.303 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.16 87.5 0.79 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.806 0.813 . . . . 0.0 109.477 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.074 HG21 ' CD2' ' A' ' 14' ' ' TYR . 4.7 m -71.43 -155.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.271 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.668 ' CB ' ' HA ' ' B' ' 102' ' ' LYS . 22.3 t70 91.24 -19.04 0.14 Allowed 'General case' 0 C--N 1.35 0.626 0 C-N-CA 123.689 0.795 . . . . 0.0 109.783 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.3 m -110.26 -69.6 0.86 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.852 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.647 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -51.69 -88.71 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.742 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.579 ' O ' ' HB2' ' B' ' 132' ' ' MET . 1.3 m 175.29 46.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.323 0.965 . . . . 0.0 111.874 -178.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.074 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.44 -44.72 15.69 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -179.663 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 61.5 mt-30 -47.99 -38.43 16.96 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -175.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.876 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.0 OUTLIER -61.38 -57.38 12.51 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.746 0.703 . . . . 0.0 112.669 -179.718 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.79 ' CB ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -47.31 -48.84 25.04 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.431 0.634 . . . . 0.0 112.128 -178.053 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.621 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 2.9 pttt -78.98 -29.39 43.79 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.262 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.94 -27.46 68.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.715 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.643 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.33 -43.06 11.8 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.667 -0.683 . . . . 0.0 110.445 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.5 t70 168.98 15.3 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.55 HG11 HD13 ' A' ' 27' ' ' LEU . 65.7 t -142.4 84.75 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -177.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.01 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -71.77 51.47 0.2 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.206 0.526 . . . . 0.0 110.852 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.143 HD11 HD12 ' B' ' 105' ' ' ILE . 0.9 OUTLIER 40.9 -8.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 118.97 2.952 . . . . 0.0 118.97 179.479 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.486 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -38.52 -63.24 0.52 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-N 119.99 1.268 . . . . 0.0 110.439 -179.022 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.1 -28.44 34.08 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.549 178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.64 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 11.3 tp -63.3 -62.19 1.85 Allowed 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.717 0.259 . . . . 0.0 110.692 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.005 HG22 HG22 ' B' ' 128' ' ' VAL . 2.3 t -45.65 -64.61 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 O-C-N 123.373 0.421 . . . . 0.0 110.426 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.648 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 4.8 p -49.18 -35.26 16.51 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 123.136 0.273 . . . . 0.0 111.57 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 19.4 m -69.95 -52.15 26.82 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.503 ' CG2' HD11 ' B' ' 127' ' ' LEU . 86.0 m -55.89 -39.02 70.95 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.293 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.909 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.3 OUTLIER -54.84 -55.51 29.54 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.695 179.198 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -44.87 87.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.103 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.1 -50.82 62.75 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.184 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.763 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.64 -33.88 76.91 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.137 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.703 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -61.28 -45.09 95.93 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.77 -51.94 55.03 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.839 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.544 0 CA-C-N 114.055 -1.429 . . . . 0.0 113.531 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.668 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 10.0 mmtt . . . . . 0 N--CA 1.467 0.378 0 CA-C-O 120.562 0.22 . . . . 0.0 111.267 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.871 ' O ' HG22 ' A' ' 9' ' ' VAL . 16.6 tp60 -121.19 125.8 48.08 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 121.66 0.743 . . . . 0.0 111.609 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.427 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 1.7 ttm180 -83.81 116.62 22.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.317 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.143 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -94.53 123.48 46.66 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.313 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.659 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -131.07 111.93 12.44 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.482 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.811 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.56 98.25 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 175.783 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.976 HG22 ' HG3' ' A' ' 4' ' ' ARG . 72.1 p -68.25 93.44 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.842 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.067 HG21 ' CB ' ' B' ' 114' ' ' TYR . 6.3 t -80.57 -125.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.143 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.688 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.6 t70 83.21 -15.22 0.66 Allowed 'General case' 0 C--N 1.349 0.557 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -176.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.11 -59.25 1.42 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.997 177.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.66 ' HB2' HG13 ' B' ' 109' ' ' VAL . 1.2 m-20 -46.24 -98.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' MET . 24.9 t -175.6 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.461 -0.774 . . . . 0.0 110.504 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.067 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -81.63 -46.58 14.17 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.014 0.926 . . . . 0.0 113.406 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.94 -40.78 31.54 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.797 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.703 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -53.66 -25.35 17.66 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.661 0.664 . . . . 0.0 112.385 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.11 -60.43 2.37 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.711 0.767 . . . . 0.0 110.269 178.472 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.7 pttt -62.4 -25.11 67.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.19 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.64 -23.93 19.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.18 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.593 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 65.9 m-85 -87.52 -50.98 6.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 24.0 t0 136.83 54.52 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 O-C-N 124.726 1.266 . . . . 0.0 109.913 179.032 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.625 ' CG1' HD13 ' B' ' 117' ' ' LEU . 7.1 p -154.1 87.1 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.095 -178.014 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.948 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -70.55 52.9 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.948 HD12 ' O ' ' B' ' 123' ' ' ASN . 1.3 pp 29.08 10.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 119.433 3.123 . . . . 0.0 119.433 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 125' ' ' SER . . . . . 1.044 ' HA ' HG22 ' A' ' 7' ' ' VAL . 3.2 p -37.24 -60.91 0.62 Allowed 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 122.765 0.426 . . . . 0.0 110.891 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.725 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.95 -19.55 61.05 Favored Glycine 0 C--O 1.222 -0.644 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.279 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.725 HD12 ' CG2' ' B' ' 124' ' ' ILE . 2.7 tm? -67.36 -56.44 9.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 117.151 0.476 . . . . 0.0 110.745 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.005 HG22 HG22 ' A' ' 28' ' ' VAL . 95.5 t -59.06 -68.65 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 120.951 0.405 . . . . 0.0 110.157 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.647 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 56.3 p -50.32 -38.24 40.66 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.725 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -82.57 -50.02 9.25 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.177 1.353 . . . . 0.0 111.413 -179.286 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -51.43 -31.44 22.97 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.973 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.79 ' SD ' ' CB ' ' A' ' 17' ' ' LEU . 2.1 mmt -61.3 -50.57 72.44 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.227 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.573 ' CB ' ' CB ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -49.94 -40.32 43.24 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.518 0.599 . . . . 0.0 111.171 179.4 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -68.18 -49.41 61.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.773 ' HB2' HD21 ' A' ' 17' ' ' LEU . 4.3 mm-40 -77.28 -18.94 57.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.862 0.363 . . . . 0.0 110.532 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.876 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -75.21 -34.97 61.53 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -56.14 4.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 121.785 0.802 . . . . 0.0 109.516 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.915 0 CA-C-N 114.016 -1.447 . . . . 0.0 114.781 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.514 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 5.2 mtmt . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.581 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.682 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 20.1 tp60 -118.46 113.78 21.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.029 0.442 . . . . 0.0 111.08 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.797 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.96 107.98 13.17 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.746 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.992 HD13 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -112.78 128.05 69.69 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.779 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -127.87 136.26 51.16 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.53 -177.022 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 1.063 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.65 106.89 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.326 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 3.2 p -70.37 91.74 0.77 Allowed 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.721 -0.392 . . . . 0.0 109.957 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.979 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.3 t -85.39 -139.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.112 -178.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.549 ' H ' HG12 ' A' ' 9' ' ' VAL . 24.8 t0 92.32 -10.4 0.2 Allowed 'General case' 0 C--N 1.35 0.606 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -175.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 m -129.67 -54.06 1.15 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.06 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.82 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -48.1 -99.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.863 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.505 ' N ' ' HB2' ' B' ' 129' ' ' SER . 0.2 OUTLIER -176.28 37.64 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.32 -0.863 . . . . 0.0 110.734 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.979 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.75 -35.27 26.76 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.368 1.067 . . . . 0.0 113.786 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.518 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.95 -46.25 43.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.728 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.679 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -50.64 -33.32 21.9 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.9 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 2.2 mt -74.52 -60.07 2.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.361 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.98 -26.29 68.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.716 0.77 . . . . 0.0 109.815 178.384 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -31.61 72.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.883 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.684 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.24 -38.73 15.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.331 179.491 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.684 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 29.8 t70 146.83 31.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.552 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 54.6 t -161.61 99.85 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 O-C-N 122.254 -0.279 . . . . 0.0 111.071 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.523 ' O ' ' HE1' ' B' ' 132' ' ' MET . 42.3 m-80 -54.3 -88.34 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.896 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -161.4 7.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.5 p -38.72 -62.74 0.58 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.551 0.614 . . . . 0.0 110.748 -177.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.4 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -84.18 -30.52 28.0 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.722 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.896 ' HB3' HG22 ' A' ' 24' ' ' ILE . 1.1 tm? -59.8 -59.91 4.68 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.782 0.291 . . . . 0.0 110.769 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.884 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -49.71 -65.4 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.902 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -49.22 -41.06 36.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.3 m -67.69 -54.08 22.43 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -40.01 94.16 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.088 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.812 ' SD ' ' CB ' ' B' ' 117' ' ' LEU . 3.5 mmt -57.97 -58.05 10.1 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.677 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.637 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.1 OUTLIER -51.86 -37.91 53.97 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.118 0.417 . . . . 0.0 111.398 179.804 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.04 -55.38 7.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.813 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -21.47 64.8 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.047 0.451 . . . . 0.0 109.81 178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -73.44 -49.18 28.26 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -51.12 69.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.769 0.795 . . . . 0.0 109.324 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.741 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.173 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 9.3 mmtm . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 121.003 0.43 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.717 ' OE1' HG22 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -95.98 114.88 26.64 Favored 'General case' 0 CA--C 1.495 -1.157 0 CA-C-O 121.094 0.473 . . . . 0.0 111.979 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.7 ' CZ ' HG21 ' A' ' 6' ' ' THR . 7.4 ttt-85 -79.31 98.97 6.89 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.658 -0.817 . . . . 0.0 108.998 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.717 HG22 ' OE1' ' B' ' 103' ' ' GLN . 0.3 OUTLIER -99.02 110.69 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.998 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.779 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -116.25 120.4 38.84 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.127 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.992 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.19 109.56 25.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 174.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.797 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.1 p -70.28 80.38 0.53 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.932 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.4 p -87.97 -140.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.358 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.702 ' H ' HG22 ' B' ' 109' ' ' VAL . 3.3 t70 86.44 -3.9 0.72 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 122.103 0.954 . . . . 0.0 108.854 -175.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.32 -64.91 1.09 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.152 177.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.799 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -44.48 -85.85 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.038 -179.212 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.637 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 2.2 m 176.38 39.51 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 119.011 0.823 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.932 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.58 -43.22 15.91 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.621 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.8 OUTLIER -47.65 -39.26 16.65 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -174.328 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.811 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.7 -56.04 26.78 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.444 1.02 . . . . 0.0 111.734 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.812 ' CB ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -52.11 -43.56 64.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.998 -178.326 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.621 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -79.26 -31.97 43.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.492 179.007 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -57.3 -30.21 64.55 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.493 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.713 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.45 -46.26 9.28 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 118.366 -0.826 . . . . 0.0 109.731 178.463 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.657 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 155.95 32.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.875 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.542 ' O ' HG12 ' B' ' 122' ' ' VAL . 46.4 t -145.88 84.53 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.041 ' O ' HD12 ' B' ' 124' ' ' ILE . 53.4 m-80 -68.95 61.22 0.1 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.076 0.465 . . . . 0.0 110.887 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.063 HD13 HG12 ' A' ' 7' ' ' VAL . 0.7 OUTLIER 42.57 -6.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -179.602 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.486 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.88 -62.86 0.58 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.789 1.177 . . . . 0.0 110.274 -179.008 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.05 -29.7 24.96 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.482 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.723 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -59.22 -61.16 2.84 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.827 0.451 . . . . 0.0 110.233 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.979 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -49.64 -59.23 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.563 179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.0 p -50.0 -39.77 42.36 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 52.2 m -70.14 -50.35 41.36 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 6.8 m -61.63 -43.73 98.31 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.086 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.9 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 7.0 mtt -59.54 -57.5 12.68 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.104 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -42.86 71.31 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.163 0.289 . . . . 0.0 111.393 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -66.76 -53.08 36.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.561 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -64.07 -32.67 74.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.679 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -68.05 -50.9 52.41 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.272 0.629 . . . . 0.0 111.18 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -52.39 63.83 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 . . . . . 0 CA--C 1.541 0.606 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.458 179.307 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.539 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 44.2 tp60 -123.67 118.44 27.26 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.372 0.606 . . . . 0.0 112.057 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.04 115.28 18.61 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.308 179.191 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.718 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -110.18 123.24 65.91 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.458 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.31 126.03 34.29 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.579 -177.017 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.799 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -102.13 107.15 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.625 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 3.5 p -70.86 89.38 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.143 0.497 . . . . 0.0 110.864 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.182 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.9 m -83.25 -150.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.808 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.569 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 25.5 t0 94.82 -7.87 0.11 Allowed 'General case' 0 C--N 1.348 0.519 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -127.98 -59.6 1.18 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.466 -1.243 . . . . 0.0 108.854 176.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.16 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.419 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.4 OUTLIER -175.41 38.35 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.288 0.949 . . . . 0.0 111.107 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.182 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.98 -44.88 16.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.171 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.581 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 13.1 mt-30 -49.24 -43.72 42.97 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.658 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -53.25 -30.97 41.19 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 118.589 0.632 . . . . 0.0 112.132 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.966 ' CD1' HD22 ' A' ' 27' ' ' LEU . 1.7 mt -77.78 -51.77 9.99 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.988 0.423 . . . . 0.0 111.69 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.668 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -65.79 -25.35 67.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.411 0.624 . . . . 0.0 110.199 178.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.55 -31.02 55.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.747 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.57 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 46.1 m-85 -88.63 -39.82 13.78 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.22 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.2 t70 118.33 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.474 1.13 . . . . 0.0 110.149 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.546 ' HB ' HD22 ' A' ' 17' ' ' LEU . 64.6 t -130.59 -47.5 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.156 0 CA-C-N 113.979 -1.464 . . . . 0.0 109.46 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.598 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.8 m120 58.3 -113.86 0.73 Allowed 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.111 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.959 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.0 -0.45 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 115.872 1.805 . . . . 0.0 115.872 -179.556 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 24' ' ' ILE . 9.2 t -39.78 -64.44 0.49 Allowed 'General case' 0 C--O 1.24 0.59 0 C-N-CA 119.575 -0.85 . . . . 0.0 109.968 -178.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.534 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -81.45 -27.06 49.39 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.245 178.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.966 HD22 ' CD1' ' A' ' 17' ' ' LEU . 5.3 tp -62.5 -61.52 2.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.768 0.284 . . . . 0.0 111.008 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.823 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.7 t -51.83 -70.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.755 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 38.5 p -47.68 -42.53 25.02 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.534 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -74.57 -45.64 44.08 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 119.032 0.833 . . . . 0.0 109.778 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.571 HG23 HD11 ' B' ' 127' ' ' LEU . 0.5 OUTLIER -68.47 -27.92 66.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.568 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.887 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.5 mmt -57.08 -55.63 32.22 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.368 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.47 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.63 -53.34 53.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.03 0.443 . . . . 0.0 110.42 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.47 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 1.9 m-20 -57.28 -50.83 71.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.049 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HG3' HD21 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -68.43 -30.27 69.11 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.13 0.491 . . . . 0.0 109.874 177.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.73 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -67.04 -43.26 83.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.065 0.459 . . . . 0.0 110.374 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -78.91 -54.67 5.82 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.273 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 tpp180 . . . . . 0 N--CA 1.444 -0.741 0 CA-C-N 114.662 -1.154 . . . . 0.0 114.039 -176.462 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.503 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.563 0 CA-C-O 120.843 0.354 . . . . 0.0 111.064 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.536 ' HB3' HG23 ' A' ' 9' ' ' VAL . 7.8 tt0 -107.03 109.17 20.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.348 0.594 . . . . 0.0 111.45 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 5.7 ttm180 -78.54 104.82 9.39 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.787 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.86 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.3 pt -104.94 126.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -130.58 124.54 32.01 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 119.618 -0.833 . . . . 0.0 112.859 -177.608 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.884 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.94 103.95 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 173.973 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.839 HG22 ' HG3' ' A' ' 4' ' ' ARG . 15.9 p -66.24 93.06 0.2 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.921 0.391 . . . . 0.0 110.673 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' HB2' ' B' ' 114' ' ' TYR . 1.4 t -96.49 -135.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.596 -178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.539 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 5.4 t70 101.06 12.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 122.623 1.201 . . . . 0.0 108.615 -175.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.569 ' H ' HG12 ' B' ' 109' ' ' VAL . 44.8 m -159.65 -48.23 0.05 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.065 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.755 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -69.59 50.62 0.1 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.772 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 32' ' ' MET . 0.1 OUTLIER 57.9 3.05 0.2 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 177.625 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.936 ' HB2' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -59.08 -56.48 21.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 118.377 0.535 . . . . 0.0 111.817 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.567 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 28.6 mt-30 -48.84 -35.95 15.79 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.73 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -53.69 -43.88 69.28 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.418 0.554 . . . . 0.0 111.218 179.61 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.887 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.3 mt -65.47 -55.38 18.27 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.681 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -66.8 -25.49 66.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.96 179.778 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.476 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.36 -25.28 23.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.919 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.713 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.3 m-30 -88.12 -51.24 5.9 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.9 OUTLIER 132.53 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 O-C-N 125.069 1.481 . . . . 0.0 110.996 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.85 ' CG1' HD22 ' B' ' 117' ' ' LEU . 7.8 p -142.72 -39.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.658 ' O ' HD13 ' B' ' 117' ' ' LEU . 28.9 m-80 61.63 -120.96 0.75 Allowed 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.065 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.48 6.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -39.77 -63.92 0.54 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.13 0.491 . . . . 0.0 110.369 -178.253 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.55 -27.66 26.61 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.167 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -61.99 -62.22 1.94 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.44 0.296 . . . . 0.0 110.789 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.065 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -50.29 -59.27 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.783 178.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.716 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.5 p -50.39 -38.0 40.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 99.5 m -72.23 -55.6 6.95 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.464 HG22 HD21 ' A' ' 27' ' ' LEU . 54.5 m -56.52 -40.28 74.77 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.261 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.947 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -54.17 -56.12 21.27 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.731 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -58.33 -37.68 75.61 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.07 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -29.01 69.29 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.658 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -65.35 -47.75 75.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.95 0.405 . . . . 0.0 110.273 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -72.76 -50.98 21.01 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.738 0.78 . . . . 0.0 110.386 178.565 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.434 ' CZ ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.638 0 CA-C-N 114.078 -1.419 . . . . 0.0 113.78 -177.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 1.5 mmtt . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 121.188 0.518 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' B' ' 108' ' ' THR . 13.5 tp60 -95.36 121.56 37.15 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.023 ' HG3' HG22 ' B' ' 108' ' ' THR . 1.0 OUTLIER -77.68 102.95 7.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 121.499 0.666 . . . . 0.0 111.573 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.78 HD11 HG11 ' A' ' 28' ' ' VAL . 1.1 pt -100.79 111.57 30.88 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.567 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.54 120.48 38.87 Favored 'General case' 0 C--N 1.313 -1.02 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.846 -176.501 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.758 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.43 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.31 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.9 OUTLIER -68.06 79.94 0.22 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 -178.578 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.032 HG21 ' CD2' ' A' ' 14' ' ' TYR . 18.6 m -75.54 -145.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.701 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.94 -12.61 0.33 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.0 m -118.72 -62.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.09 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.875 ' HB2' ' CB ' ' B' ' 129' ' ' SER . 1.3 p30 -47.5 -91.84 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -175.87 41.19 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.423 -0.798 . . . . 0.0 111.342 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.088 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -79.16 -41.8 27.63 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.588 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.59 -46.33 39.2 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -176.718 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.874 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -47.92 -33.88 8.26 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.598 0.713 . . . . 0.0 112.304 179.547 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.978 HD13 HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -77.4 -60.48 2.35 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.705 179.577 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.588 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -59.41 -25.65 64.49 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.308 179.51 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -59.12 -31.32 68.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.232 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.863 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -93.78 -27.95 16.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.565 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 27.5 t70 121.46 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.133 0.973 . . . . 0.0 110.812 176.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.978 HG13 HD13 ' A' ' 17' ' ' LEU . 8.5 p -150.25 77.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.565 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.966 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -73.54 51.98 0.37 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 0.0 111.935 -179.898 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.002 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 40.75 -2.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 118.479 2.77 . . . . 0.0 118.479 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 23' ' ' ASN . 3.9 p -38.19 -62.96 0.52 Allowed 'General case' 0 C--O 1.24 0.587 0 CA-C-N 119.479 1.036 . . . . 0.0 110.378 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.424 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -85.64 -34.41 13.73 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.988 177.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.615 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -53.4 -61.34 2.36 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 120.825 0.345 . . . . 0.0 110.592 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.002 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -50.99 -68.24 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.473 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.635 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.4 m -50.09 -41.27 47.89 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 2.0 m -70.03 -51.63 30.6 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -56.12 -38.73 71.17 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.549 178.626 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.909 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.0 mtt -60.32 -56.17 24.68 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.82 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -48.85 -40.86 31.17 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.052 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -63.62 -57.06 11.27 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -10.09 59.21 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.093 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -87.0 -37.65 17.31 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -50.33 19.24 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.996 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.637 0 CA-C-N 113.948 -1.478 . . . . 0.0 111.876 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 8.4 mttm . . . . . 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.675 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -105.97 100.34 9.9 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.459 0.647 . . . . 0.0 110.86 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.682 ' NH2' HG21 ' B' ' 106' ' ' THR . 4.1 ttp180 -78.99 99.45 6.86 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.337 0.589 . . . . 0.0 110.632 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.088 HD13 ' CD1' ' A' ' 14' ' ' TYR . 21.8 pt -104.31 129.88 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.784 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 177.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.682 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.4 OUTLIER -131.35 125.83 33.68 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.428 -0.909 . . . . 0.0 112.84 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.763 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.8 98.29 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 108' ' ' THR . . . . . 1.023 HG22 ' HG3' ' A' ' 4' ' ' ARG . 68.1 p -66.87 95.79 0.39 Allowed 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.0 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.9 t -85.77 -128.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.915 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.599 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 24.0 t70 82.66 -12.56 0.89 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.923 0.783 . . . . 0.0 108.939 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -125.12 -61.44 1.29 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.01 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.804 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -44.4 -94.4 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.577 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.415 ' N ' ' HB3' ' A' ' 29' ' ' SER . 34.2 t 179.42 41.75 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.871 0.759 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.0 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.51 -45.32 13.72 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.649 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.5 mt-30 -48.89 -39.27 25.31 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -174.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.637 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -58.29 -52.62 64.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.239 0.927 . . . . 0.0 111.752 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.909 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -49.07 -49.97 38.97 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.432 0.634 . . . . 0.0 111.422 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.649 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 2.1 pttt -76.01 -29.25 58.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.474 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' B' ' 116' ' ' LEU . . . -64.12 -28.18 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.083 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.578 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -87.72 -42.75 12.41 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 118.819 -0.61 . . . . 0.0 109.699 178.894 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.578 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 155.89 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 176.882 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.508 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 76.0 t -154.19 91.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 121.816 -0.552 . . . . 0.0 111.777 -177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.571 ' HB2' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -57.51 -88.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 178.349 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.008 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -154.72 -0.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 115.864 1.801 . . . . 0.0 115.864 179.039 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 22.0 p -39.46 -63.16 0.59 Allowed 'General case' 0 C--O 1.241 0.62 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.563 -179.111 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.82 -30.11 24.5 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 121.293 -0.48 . . . . 0.0 112.214 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.676 ' HB3' HG22 ' B' ' 124' ' ' ILE . 5.8 tp -58.59 -61.03 2.9 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.776 0.288 . . . . 0.0 110.33 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.008 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.5 t -51.37 -64.63 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.012 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.875 ' CB ' ' HB2' ' A' ' 12' ' ' ASP . 7.8 p -48.41 -45.0 35.53 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -46.63 51.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 25.4 m -60.64 -37.9 83.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.917 178.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.85 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.79 -58.4 8.74 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.978 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -58.79 -36.06 73.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.888 -178.875 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -74.07 -49.51 23.73 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.529 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.756 ' HG3' HD21 ' A' ' 17' ' ' LEU . 21.6 tp10 -69.95 -20.24 63.34 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.874 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.36 -52.78 5.01 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 13.8 mtt180 -57.28 -56.62 19.5 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 121.503 0.668 . . . . 0.0 110.2 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.421 ' HD3' ' O ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.021 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.623 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' B' ' 109' ' ' VAL . 5.9 mmtm . . . . . 0 N--CA 1.467 0.4 0 CA-C-O 120.866 0.365 . . . . 0.0 110.872 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' B' ' 109' ' ' VAL . 1.7 tt0 -109.83 108.82 19.27 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.028 0.442 . . . . 0.0 110.235 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.803 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.1 ttm105 -79.63 110.15 14.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.969 . . . . 0.0 112.239 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.94 HD11 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -104.82 130.95 55.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 176.972 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.76 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -131.48 130.02 41.9 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.435 -1.306 . . . . 0.0 113.523 -177.213 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.898 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.51 98.21 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.619 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.501 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 1.2 p -71.08 67.42 0.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.581 0.705 . . . . 0.0 109.529 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 10' ' ' ASP . 7.1 p -88.83 -131.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-O 117.433 -1.27 . . . . 0.0 109.961 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 9' ' ' VAL . 32.3 t70 114.43 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 119.759 1.163 . . . . 0.0 110.975 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.475 ' H ' HG22 ' A' ' 9' ' ' VAL . 63.1 p 173.64 -27.29 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.524 -1.217 . . . . 0.0 113.379 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.741 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 33.0 m-20 -80.89 70.06 7.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.249 -0.981 . . . . 0.0 112.118 -177.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.542 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 34.5 m 57.46 -11.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 178.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.823 ' CE1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -56.84 -53.77 54.07 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.113 0.87 . . . . 0.0 109.868 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.2 mt-30 -49.35 -42.24 41.25 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.476 -178.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -53.63 -56.06 20.5 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.371 0.532 . . . . 0.0 111.843 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.787 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.06 -47.55 33.82 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.121 -179.18 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.782 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 22.8 pttt -79.42 -30.5 42.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.178 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -26.39 68.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.862 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.728 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.02 -43.94 11.35 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 118.636 -0.697 . . . . 0.0 109.481 178.418 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 154.49 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 176.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.449 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 74.4 t -157.93 90.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 CA-C-O 120.785 0.326 . . . . 0.0 110.642 -178.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.782 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -57.22 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.404 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.09 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -150.08 -2.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 179.866 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 24' ' ' ILE . 55.6 p -39.61 -65.01 0.42 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.896 -177.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.605 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.66 -24.33 50.33 Favored Glycine 0 C--O 1.228 -0.25 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.603 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -64.24 -62.27 1.72 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 122.482 0.313 . . . . 0.0 111.324 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.09 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.5 t -53.18 -62.74 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 O-C-N 123.02 0.2 . . . . 0.0 110.815 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.807 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 12.9 p -48.35 -40.04 24.15 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -75.7 -45.82 34.68 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.416 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.66 ' HB ' HD21 ' B' ' 127' ' ' LEU . 1.9 p -57.84 -45.01 86.86 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 178.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.131 ' HA ' HD12 ' B' ' 117' ' ' LEU . 4.0 mmt -57.5 -57.19 13.77 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.151 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.428 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.0 OUTLIER -57.91 -39.83 78.89 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -63.65 -57.27 10.59 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.843 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.65 ' OE1' HD11 ' B' ' 117' ' ' LEU . 5.8 mt-10 -70.97 -14.49 62.38 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.825 178.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.812 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.22 -28.85 22.13 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 120.998 0.428 . . . . 0.0 110.822 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -49.84 10.9 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.974 0.893 . . . . 0.0 109.277 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.78 0 CA-C-N 113.884 -1.507 . . . . 0.0 112.554 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.202 0.525 . . . . 0.0 111.613 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.723 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.8 OUTLIER -111.04 108.29 17.97 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.526 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.858 ' NH2' HG21 ' B' ' 106' ' ' THR . 5.0 ttp180 -77.44 104.67 8.1 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.474 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.018 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -95.61 109.17 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.668 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.858 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -117.95 116.94 27.94 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 118.759 -1.176 . . . . 0.0 113.158 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.94 HG13 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -100.73 103.18 14.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.803 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 17.9 p -70.33 87.3 0.61 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.777 0.799 . . . . 0.0 110.249 -178.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.334 HG21 ' CD1' ' B' ' 114' ' ' TYR . 19.7 m -72.78 -137.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.912 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.671 ' N ' HG23 ' B' ' 109' ' ' VAL . 26.9 t0 92.3 -8.43 0.2 Allowed 'General case' 0 C--N 1.356 0.864 0 CA-C-O 121.458 0.646 . . . . 0.0 109.603 -177.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 6.1 t -136.47 -55.24 0.74 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.489 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.807 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -44.04 -94.25 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -177.625 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 32' ' ' MET . 0.1 OUTLIER 176.48 37.56 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.963 0.802 . . . . 0.0 110.939 -179.508 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.334 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.22 -43.97 15.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -179.293 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.732 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.2 mm100 -47.55 -37.46 12.3 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -174.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.812 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -64.32 -56.96 10.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.053 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 1.131 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -52.33 -41.42 62.98 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.255 -177.142 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.3 OUTLIER -79.38 -29.37 42.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.627 -179.846 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -64.38 -30.63 71.67 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.39 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.997 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.95 -40.47 13.02 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.499 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 22.2 t70 170.2 15.01 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.933 ' HB ' HD22 ' B' ' 117' ' ' LEU . 51.4 t -135.45 76.15 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 121.333 -0.854 . . . . 0.0 113.101 -177.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.115 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m120 -66.06 57.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.115 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.2 OUTLIER 50.99 -26.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.96 -64.22 0.42 Allowed 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.395 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.632 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.37 -20.77 53.92 Favored Glycine 0 C--O 1.227 -0.332 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.415 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.802 ' HG ' HD13 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.39 -60.35 4.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.998 HG23 HG22 ' B' ' 124' ' ' ILE . 74.8 t -54.1 -65.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.719 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.741 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 52.5 p -49.17 -46.95 46.14 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -75.41 -50.33 16.21 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 119.376 0.989 . . . . 0.0 110.358 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.662 ' HB ' HD22 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.12 -44.14 74.73 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.435 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.894 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.7 mmt -52.35 -45.66 65.78 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.203 178.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.542 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -52.93 -48.0 67.63 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.904 0.383 . . . . 0.0 111.535 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.7 -51.59 67.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -77.4 -9.29 58.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.977 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -88.05 -33.97 18.13 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -55.67 5.45 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 121.782 0.801 . . . . 0.0 109.354 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.517 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 4.6 mmp_? . . . . . 0 N--CA 1.442 -0.866 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.457 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.334 0 CA-C-O 120.658 0.266 . . . . 0.0 110.945 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.781 ' HB3' ' CB ' ' B' ' 110' ' ' ASP . 1.4 tp60 -114.55 129.11 56.64 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.762 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.89 ' NH2' HG21 ' A' ' 6' ' ' THR . 15.1 ttp85 -78.31 99.41 6.31 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.714 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.804 HG21 ' CG ' ' B' ' 114' ' ' TYR . 1.3 pt -94.61 113.86 30.01 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.236 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.713 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.89 HG21 ' NH2' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -119.6 122.69 42.14 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.092 -1.043 . . . . 0.0 112.581 -178.013 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.93 HG12 HG22 ' B' ' 105' ' ' ILE . 2.1 p -99.23 106.75 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 114.242 -1.345 . . . . 0.0 107.936 177.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.409 ' CG2' ' CZ ' ' B' ' 104' ' ' ARG . 0.7 OUTLIER -70.1 68.09 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.098 0.951 . . . . 0.0 108.6 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.832 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.8 p -72.54 -142.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.581 -1.645 . . . . 0.0 112.895 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.674 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 7.1 t70 86.61 -5.3 0.72 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.763 0.792 . . . . 0.0 109.311 -176.066 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.46 -73.03 0.66 Allowed 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.341 177.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.0 m-20 -32.94 -77.26 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.789 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.478 ' N ' ' HB2' ' B' ' 129' ' ' SER . 1.8 m 167.22 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.188 0.518 . . . . 0.0 111.106 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.913 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -84.6 -47.14 10.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 179.728 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.9 mt-30 -48.91 -38.94 24.23 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -174.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.68 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -52.07 -57.61 9.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.485 1.038 . . . . 0.0 111.574 179.17 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.003 ' CD1' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -55.4 -44.25 76.01 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.648 -177.782 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -76.28 -25.65 55.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.065 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -29.27 53.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.732 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.654 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.4 m-30 -87.71 -46.24 9.67 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 177.484 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 138.51 34.94 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.874 1.359 . . . . 0.0 111.223 177.832 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.56 ' HB ' HD13 ' A' ' 17' ' ' LEU . 16.4 t -116.01 76.59 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.014 0.435 . . . . 0.0 111.875 -178.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 16.2 p30 -67.84 44.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER 39.52 1.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 178.044 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' ASN . 6.9 p -38.57 -63.59 0.5 Allowed 'General case' 0 C--O 1.244 0.802 0 CA-C-N 119.048 0.84 . . . . 0.0 110.904 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.422 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -86.22 -21.37 52.36 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.613 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 1.003 HD12 ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -71.2 -62.54 1.36 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.896 0.348 . . . . 0.0 111.223 -179.376 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.028 HG21 HG22 ' B' ' 128' ' ' VAL . 2.1 t -51.05 -62.23 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.679 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 17.8 p -48.83 -31.12 6.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 122.651 0.38 . . . . 0.0 111.842 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -77.06 -57.92 3.57 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 m -52.96 -44.64 67.26 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.158 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.799 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 3.4 mmt -49.34 -43.55 43.86 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.411 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.569 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -63.61 -48.77 75.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.106 0.412 . . . . 0.0 110.44 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -60.82 -53.34 58.51 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.686 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -61.6 -41.8 97.95 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.269 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.783 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -58.46 -44.44 89.26 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.352 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.401 ' NH2' ' OE1' ' A' ' 33' ' ' GLN . 4.6 mtt-85 -69.5 -54.53 13.76 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 34' ' ' ASN . 3.8 mmp_? . . . . . 0 N--CA 1.445 -0.721 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.232 -178.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.647 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 15.4 mmtt . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.674 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 11.5 tp60 -125.97 124.64 41.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.083 0.468 . . . . 0.0 111.231 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.463 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.31 112.24 16.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.032 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.934 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -107.16 128.94 61.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.182 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.175 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.789 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.47 120.18 22.63 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.696 -179.804 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.67 HG23 HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -103.5 93.69 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 174.342 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.882 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.8 p -70.52 89.31 0.7 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.045 -1.034 . . . . 0.0 109.687 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 21.6 m -141.35 -0.98 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.781 ' CB ' ' HB3' ' A' ' 3' ' ' GLN . 0.0 OUTLIER 17.85 -74.65 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.645 1.111 . . . . 0.0 112.209 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.62 ' N ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -66.7 -20.16 65.91 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -179.143 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.696 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 1.2 t0 -78.72 62.8 3.33 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 120.017 1.28 . . . . 0.0 111.132 -178.144 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.569 ' HB3' ' CA ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER 58.91 -24.87 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 179.507 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.804 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.02 -56.52 3.29 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-O 121.708 0.766 . . . . 0.0 110.424 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.591 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 20.3 pt20 -49.54 -39.93 36.37 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.713 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.783 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -60.61 -43.84 97.0 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.664 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.799 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.45 -50.03 74.43 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.457 0.646 . . . . 0.0 111.439 -179.314 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.8 pttt -70.13 -25.88 63.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.581 178.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -60.38 -26.67 66.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.54 177.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.691 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.7 OUTLIER -88.41 -44.94 10.38 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.372 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.691 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 150.13 63.0 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 176.852 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.735 ' CG1' HD23 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -157.6 -42.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.985 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.2 OUTLIER 58.18 59.26 3.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.465 0.65 . . . . 0.0 110.014 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.999 ' HB ' HG23 ' B' ' 128' ' ' VAL . 0.5 OUTLIER 40.53 -11.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 118.478 2.77 . . . . 0.0 118.478 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.736 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.03 -56.43 1.15 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.112 -177.888 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.76 -24.63 52.66 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.533 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.87 ' HB3' HG22 ' B' ' 124' ' ' ILE . 1.0 OUTLIER -70.32 -61.48 1.76 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.971 0.509 . . . . 0.0 111.142 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.028 HG22 HG21 ' A' ' 28' ' ' VAL . 71.0 t -46.42 -54.4 2.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.787 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.05 -40.73 86.01 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 90.6 m -74.05 -49.84 22.36 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.606 HG22 ' O ' ' B' ' 128' ' ' VAL . 3.4 t -55.34 -30.86 61.08 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.674 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.844 ' HE1' HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.69 -57.61 11.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.779 179.023 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -46.03 85.07 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -64.54 -50.59 66.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.812 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.593 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -71.84 -25.04 61.81 Favored 'General case' 0 C--O 1.217 -0.642 0 C-N-CA 120.349 -0.54 . . . . 0.0 110.069 178.267 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.68 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.56 -46.33 59.72 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 177.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -60.17 -56.02 26.66 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.505 0.669 . . . . 0.0 110.126 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? . . . . . 0 N--CA 1.445 -0.679 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.866 -177.559 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 120.351 0.119 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.848 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -122.77 110.02 14.94 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.651 0.739 . . . . 0.0 111.528 -179.03 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.886 ' HG3' HG23 ' B' ' 108' ' ' THR . 3.2 ttm105 -83.64 113.96 21.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.246 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.035 HD11 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -104.51 130.6 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.03 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.811 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -126.79 126.01 42.68 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.806 -0.758 . . . . 0.0 112.735 -177.469 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 HG22 ' B' ' 105' ' ' ILE . 0.6 OUTLIER -100.51 109.09 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.627 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.448 HG22 ' NH1' ' B' ' 104' ' ' ARG . 15.2 p -70.67 68.31 0.39 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.683 0.754 . . . . 0.0 109.333 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.835 HG11 ' CB ' ' A' ' 14' ' ' TYR . 8.3 p -76.23 -143.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.253 -1.34 . . . . 0.0 111.795 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.72 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 7.2 t70 87.43 1.56 0.44 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-O 122.067 0.937 . . . . 0.0 109.86 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.5 m -129.24 -64.72 0.89 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.18 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.823 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 1.2 m-20 -42.37 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.998 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m 178.54 41.61 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.607 0.639 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.912 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.5 OUTLIER -82.83 -49.48 9.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -179.166 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 4.1 mm-40 -48.15 -36.55 13.69 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -173.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.99 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.8 -53.29 59.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.86 0.754 . . . . 0.0 112.183 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.894 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.97 -45.76 51.78 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.236 0.541 . . . . 0.0 111.553 -178.287 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -77.73 -25.73 49.48 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.852 178.619 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -62.04 -28.65 69.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.621 178.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.692 ' CZ ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.12 -41.93 12.7 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.587 178.386 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.669 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 154.23 14.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 176.826 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 70.3 t -152.66 92.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 121.794 -0.566 . . . . 0.0 112.086 -177.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.465 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 4.8 p30 -58.41 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.06 HD11 HD12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -146.29 -2.67 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 115.599 1.704 . . . . 0.0 115.599 178.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -39.29 -64.37 0.47 Allowed 'General case' 0 C--O 1.245 0.82 0 C-N-CA 119.922 -0.711 . . . . 0.0 109.346 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.62 -28.67 26.2 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.058 -0.591 . . . . 0.0 111.964 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.688 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.71 -61.12 2.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.597 0.359 . . . . 0.0 110.752 179.238 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.056 HG22 HG21 ' B' ' 124' ' ' ILE . 2.4 t -51.98 -63.72 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 5.4 p -49.15 -39.05 27.41 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.5 m -71.88 -58.42 3.48 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.2 m -53.92 -42.84 69.22 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.01 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.002 ' HE1' HG23 ' B' ' 124' ' ' ILE . 11.4 mmt -56.61 -57.3 12.98 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.855 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -38.84 65.34 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -53.5 24.97 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.349 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.794 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -67.84 -25.94 65.8 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.248 178.21 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.573 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.93 -43.7 64.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -50.62 72.83 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.939 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.449 -0.522 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.221 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt . . . . . 0 N--CA 1.467 0.409 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.72 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.2 tt0 -113.97 126.25 54.93 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.355 0.598 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.503 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.86 108.32 11.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.433 -178.551 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.06 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -101.59 109.22 25.32 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.962 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.192 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.732 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -116.91 114.97 24.6 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.468 -178.488 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 1.035 HG13 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.31 111.94 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.669 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.886 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -70.02 91.47 0.68 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -179.704 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.96 HG22 HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -96.28 -158.88 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 112.152 -178.228 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.848 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 13.3 t70 96.71 -5.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.23 -61.55 1.66 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 175.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -49.93 -90.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.692 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 33.3 t -179.68 40.25 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.168 0.895 . . . . 0.0 111.229 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.98 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 1.1 t80 -82.71 -50.13 9.04 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.3 OUTLIER -47.39 -38.41 13.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.581 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.573 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.05 -44.0 64.06 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.612 1.096 . . . . 0.0 112.349 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -68.07 -47.76 67.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.075 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.613 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 2.8 pttt -72.06 -29.88 64.58 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.552 0.692 . . . . 0.0 110.483 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.98 -28.75 67.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.463 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.555 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.4 OUTLIER -88.46 -42.58 12.04 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.591 -0.719 . . . . 0.0 110.476 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.6 28.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 177.067 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.533 ' O ' HD23 ' B' ' 117' ' ' LEU . 68.7 t -160.65 96.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 122.209 -0.307 . . . . 0.0 111.726 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.613 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 2.5 m-20 -60.03 -102.75 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 178.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.056 HG21 HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -145.12 6.83 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 179.037 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 124' ' ' ILE . 2.6 p -41.6 -64.25 0.6 Allowed 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.629 0.728 . . . . 0.0 109.687 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.91 -23.19 42.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.658 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.823 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.47 -57.27 11.83 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.719 0.259 . . . . 0.0 111.018 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.057 HG22 HG21 ' A' ' 24' ' ' ILE . 5.4 t -54.21 -62.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.823 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 14.8 p -50.42 -44.19 55.09 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 87.5 m -68.55 -57.34 5.92 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.465 HG22 ' O ' ' B' ' 128' ' ' VAL . 0.7 OUTLIER -54.0 -44.41 70.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.397 179.594 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.929 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.3 mtt -60.21 -58.02 10.31 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.438 178.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.433 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.0 OUTLIER -49.35 -44.56 44.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.4 -179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -64.1 -57.4 9.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.565 0.222 . . . . 0.0 110.778 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.445 ' HB2' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.4 -15.18 62.81 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.99 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.69 -29.1 20.13 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 123.234 0.613 . . . . 0.0 111.089 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.58 -48.68 10.7 Favored 'General case' 0 CA--C 1.504 -0.825 0 CA-C-O 121.909 0.861 . . . . 0.0 110.118 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 . . . . . 0 C--N 1.319 -0.724 0 CA-C-N 113.771 -1.559 . . . . 0.0 114.298 -176.983 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 121.065 0.46 . . . . 0.0 111.037 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.748 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -103.81 111.87 24.57 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.344 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.89 105.89 9.38 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.121 -178.749 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.669 HG12 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -103.94 120.98 54.91 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.993 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 175.895 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.738 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -124.76 124.15 41.52 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.894 -177.199 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.792 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.74 108.08 21.99 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.757 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 27.3 p -70.64 89.96 0.74 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.753 0.311 . . . . 0.0 110.997 -178.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.004 HG21 ' CB ' ' A' ' 14' ' ' TYR . 3.0 t -84.44 -133.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.928 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.551 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.7 t0 85.73 -9.93 0.75 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.166 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t -135.21 -54.19 0.8 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.388 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.755 ' HB2' HG13 ' A' ' 9' ' ' VAL . 1.4 m-20 -47.39 -103.28 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -178.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.61 35.32 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.767 0.794 . . . . 0.0 111.05 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.004 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.0 -38.68 22.3 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.595 1.158 . . . . 0.0 112.608 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.63 -43.99 36.88 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -176.259 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.79 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -54.35 -44.07 71.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.316 0.962 . . . . 0.0 112.26 -179.41 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.013 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.2 OUTLIER -59.15 -52.38 65.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.622 0.725 . . . . 0.0 111.239 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -74.01 -29.37 61.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.752 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.4 -27.93 69.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.267 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.807 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -88.41 -45.02 10.32 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 118.585 -0.722 . . . . 0.0 110.356 179.096 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.677 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 159.85 18.89 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.029 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.671 ' O ' HD12 ' A' ' 17' ' ' LEU . 65.3 t -157.87 98.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 CA-C-N 118.411 0.551 . . . . 0.0 112.017 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 31.1 m-80 -57.31 -96.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.032 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.71 5.87 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 178.873 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.426 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.2 t -39.34 -64.58 0.45 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.399 -177.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.86 -25.87 28.38 Favored Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.433 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.705 HD12 ' CD1' ' A' ' 17' ' ' LEU . 6.6 tt -58.61 -61.65 2.44 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.992 0.425 . . . . 0.0 109.885 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.032 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.3 t -49.96 -62.8 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.965 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.861 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.897 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 95.4 p -49.45 -43.42 44.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.05 -47.91 40.65 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.254 -0.646 . . . . 0.0 109.254 179.68 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.612 HG21 HG21 ' B' ' 131' ' ' THR . 23.3 m -61.47 -34.59 75.72 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.6 OUTLIER -63.97 -56.86 12.04 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.79 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.51 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -50.23 -34.13 21.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.69 0.281 . . . . 0.0 110.752 179.504 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.4 m-20 -75.36 -50.29 16.4 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.168 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.724 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 mm-40 -67.76 -23.47 65.23 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.06 178.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.669 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.0 -50.12 24.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -56.1 10.42 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.295 178.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.518 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.394 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.433 ' HD3' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.155 0.502 . . . . 0.0 110.911 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.551 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 27.2 tt0 -98.79 114.23 26.69 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.887 179.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.522 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.76 102.33 7.12 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.453 -178.164 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.742 HD11 HG11 ' B' ' 128' ' ' VAL . 1.1 pt -100.79 109.74 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.696 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.71 117.18 29.55 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -175.63 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.807 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -101.16 104.47 16.31 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 173.794 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.862 HG22 ' HG3' ' A' ' 4' ' ' ARG . 44.6 p -70.1 85.12 0.54 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.209 0.528 . . . . 0.0 110.774 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.6 t -82.3 -138.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.064 -178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 4.3 t70 86.03 -5.34 0.8 Allowed 'General case' 0 C--N 1.35 0.624 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.54 -63.13 1.1 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.508 -1.223 . . . . 0.0 107.919 177.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.897 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -47.25 -92.44 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -179.218 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 26.6 t -178.82 40.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 118.903 0.774 . . . . 0.0 111.435 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.872 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.9 -41.5 18.83 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.759 0.824 . . . . 0.0 112.529 179.709 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.647 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.75 -39.55 25.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -174.924 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.669 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.49 -50.72 72.83 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.413 1.006 . . . . 0.0 111.944 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.957 HD23 ' CE2' ' B' ' 120' ' ' TYR . 2.1 mt -53.8 -43.57 69.45 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.599 0.714 . . . . 0.0 111.767 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 7.8 pttt -79.19 -32.53 44.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.52 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.482 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -61.93 -26.5 68.22 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.573 -1.194 . . . . 0.0 110.166 178.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.957 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.09 -39.52 14.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.881 179.291 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.67 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 26.2 t0 138.14 49.95 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.729 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -159.96 -37.06 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.891 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' B' ' 122' ' ' VAL . 11.9 p30 55.61 -109.61 0.5 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.047 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -144.2 1.38 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.792 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 t -38.82 -64.28 0.45 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.871 -178.629 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -89.35 -26.88 24.4 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.769 177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.65 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -55.66 -61.84 2.09 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.227 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.047 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.7 t -54.37 -55.49 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.312 0.577 . . . . 0.0 110.044 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.709 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 29.1 t -47.14 -47.66 23.49 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.1 -47.07 12.04 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.657 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.612 HG21 HG21 ' A' ' 31' ' ' THR . 2.4 m -56.43 -48.27 77.33 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.695 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.867 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 5.5 mmt -51.62 -48.55 63.25 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.768 179.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -54.58 -36.38 64.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -48.31 46.06 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 1.013 ' HB3' HD21 ' A' ' 17' ' ' LEU . 5.4 tt0 -74.62 -21.7 59.32 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.943 0.402 . . . . 0.0 110.376 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -78.09 -32.98 50.91 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.282 0.633 . . . . 0.0 110.754 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.2 mtt85 -81.98 -51.97 7.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.592 0.71 . . . . 0.0 110.655 179.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -176.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.669 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' B' ' 108' ' ' THR . 59.9 tp60 -100.14 120.33 39.71 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.016 0.436 . . . . 0.0 110.869 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.0 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.3 ttm-85 -79.29 112.44 16.52 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -177.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.784 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -118.2 122.18 68.99 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 176.77 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.753 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -131.54 140.36 49.47 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 118.918 -1.113 . . . . 0.0 112.909 -178.168 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.75 HG23 ' HB ' ' A' ' 9' ' ' VAL . 2.0 m -100.83 107.99 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.459 HG23 ' HG3' ' B' ' 104' ' ' ARG . 0.7 OUTLIER -70.42 67.64 0.34 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.622 0.725 . . . . 0.0 109.596 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.75 ' HB ' HG23 ' A' ' 7' ' ' VAL . 7.9 p -95.88 -137.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.03 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER 166.15 -82.83 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -178.903 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.618 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -104.8 9.89 34.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.19 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.752 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -80.22 68.33 6.33 Favored 'General case' 0 C--N 1.359 0.98 0 CA-C-N 119.807 1.185 . . . . 0.0 108.706 179.416 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB3' ' N ' ' B' ' 133' ' ' GLN . 2.6 m 61.16 -28.59 0.05 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.682 -1.144 . . . . 0.0 113.736 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.724 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -45.91 -60.26 2.35 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.149 0.5 . . . . 0.0 111.115 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 5.1 pt20 -48.75 -38.26 21.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.938 -177.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.674 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.02 -46.56 87.88 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.43 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.771 HD21 ' CB ' ' B' ' 135' ' ' GLU . 0.5 OUTLIER -55.34 -49.69 71.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.474 0.654 . . . . 0.0 110.849 -179.724 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.678 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.3 pttt -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.538 179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.23 -29.39 67.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.337 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.693 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.3 -44.33 10.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.526 178.917 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.589 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 152.28 27.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.393 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.5 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 76.4 t -160.15 87.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.678 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -53.89 -87.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.576 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.007 HD13 HG23 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -155.22 -1.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 179.515 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.804 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.3 p -38.91 -64.51 0.44 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-N 118.941 0.791 . . . . 0.0 111.681 -176.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.58 -19.99 57.26 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.774 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.712 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -66.8 -61.66 1.84 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 122.766 0.426 . . . . 0.0 110.741 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.935 HG23 ' CG2' ' A' ' 24' ' ' ILE . 10.0 t -50.55 -60.4 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 C-N-CA 120.309 -0.556 . . . . 0.0 109.923 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.864 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 8.8 p -50.1 -41.78 48.98 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.8 m -67.1 -52.47 41.51 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.516 HG22 HD11 ' B' ' 127' ' ' LEU . 49.1 m -61.24 -34.6 75.4 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.836 178.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.931 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.88 -58.15 6.25 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.562 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.464 ' OE1' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.92 -33.99 19.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.718 0.294 . . . . 0.0 110.885 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.41 -50.73 12.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.831 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.78 ' CB ' HD21 ' B' ' 117' ' ' LEU . 1.4 mm-40 -70.83 -19.14 62.69 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.318 177.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.788 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.49 -49.11 8.93 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.664 0.786 . . . . 0.0 110.88 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.464 ' HD2' ' OE1' ' A' ' 33' ' ' GLN . 4.7 mtt85 -57.49 -53.7 55.18 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.389 0.614 . . . . 0.0 110.886 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? . . . . . 0 N--CA 1.448 -0.565 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.869 -178.772 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.473 0 CA-C-O 120.592 0.235 . . . . 0.0 111.052 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.546 ' HG2' HG22 ' B' ' 105' ' ' ILE . 3.3 tt0 -109.93 110.57 21.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.132 0.492 . . . . 0.0 112.129 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.464 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 7.8 ttm105 -78.69 102.38 8.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.777 HD11 HG11 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -99.09 116.09 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 178.891 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.753 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -115.74 124.5 50.96 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.599 -176.662 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 1.007 HG23 HD13 ' A' ' 24' ' ' ILE . 1.1 t -100.6 98.7 7.23 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 108' ' ' THR . . . . . 1.0 HG22 ' HG3' ' A' ' 4' ' ' ARG . 48.4 p -70.16 98.66 1.37 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.97 -0.456 . . . . 0.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.104 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.0 t -88.98 -129.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.449 ' N ' HG12 ' B' ' 109' ' ' VAL . 22.5 t70 85.47 -9.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 67.3 p -131.5 -61.33 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.824 178.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.881 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -39.27 -92.54 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 28.5 t 170.85 39.38 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.731 0.776 . . . . 0.0 110.149 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.104 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -84.23 -45.17 13.16 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.26 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.7 -34.92 12.87 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.305 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.788 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -60.71 -56.92 15.51 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.678 0.672 . . . . 0.0 111.549 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.931 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.9 mt -47.16 -48.85 23.36 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.069 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -77.04 -26.21 53.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.643 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.82 -30.4 71.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.699 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.59 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.16 -41.41 13.02 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.789 178.408 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.563 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 152.95 26.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.029 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.777 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.6 OUTLIER -135.29 80.1 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -179.001 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.03 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.69 53.74 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.652 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER 42.35 -9.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 118.701 2.852 . . . . 0.0 118.701 178.88 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.565 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.25 -63.15 0.51 Allowed 'General case' 0 C--O 1.244 0.773 0 CA-C-N 119.601 1.091 . . . . 0.0 110.946 -176.966 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.49 -26.78 34.72 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.693 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.59 ' CD1' ' CD1' ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.4 -61.51 2.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.628 0.371 . . . . 0.0 110.436 179.332 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.968 HG23 ' CG2' ' B' ' 124' ' ' ILE . 4.0 t -47.74 -64.31 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.752 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.05 -34.8 10.06 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 178.574 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 98.8 m -72.44 -52.8 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -42.55 99.14 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.424 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.728 ' HE2' ' CG2' ' A' ' 24' ' ' ILE . 6.7 mmt -52.31 -51.17 60.13 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.674 179.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.498 ' N ' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.92 -36.91 68.25 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.702 0.287 . . . . 0.0 111.079 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.4 -52.51 26.25 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.771 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.77 -19.21 62.73 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.61 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.45 -28.82 21.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 122.776 0.43 . . . . 0.0 111.243 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -54.07 6.39 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 121.652 0.739 . . . . 0.0 109.871 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? . . . . . 0 N--CA 1.441 -0.892 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.12 -178.419 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.93 0.395 . . . . 0.0 110.981 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 36.7 tp60 -109.66 117.51 34.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.232 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.932 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.5 ttm180 -78.51 106.12 10.25 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 121.67 0.748 . . . . 0.0 112.221 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.969 HD13 ' CD1' ' B' ' 114' ' ' TYR . 7.0 pt -110.41 128.1 66.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 177.291 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.731 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.03 131.6 42.62 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 118.461 -1.295 . . . . 0.0 113.822 -177.497 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.95 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.48 105.39 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.453 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 7.4 p -70.55 91.68 0.8 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.281 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.022 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -88.58 -147.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.805 -178.908 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.589 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 28.4 t70 120.49 -0.28 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.327 1.051 . . . . 0.0 108.511 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.9 p -158.03 -33.12 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.079 -0.964 . . . . 0.0 112.694 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.743 ' HB2' HG13 ' A' ' 9' ' ' VAL . 2.3 m-20 -75.05 19.9 0.14 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -176.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.579 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 32.5 m 81.38 8.23 1.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 175.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.022 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -63.25 -45.77 90.01 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.504 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 7.4 mt-30 -49.62 -41.24 41.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -176.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.606 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -59.53 -48.46 81.56 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.006 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.4 OUTLIER -50.34 -56.91 9.3 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.525 0.679 . . . . 0.0 111.498 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.636 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 pttt -70.4 -25.83 63.41 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.113 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -65.71 -27.03 68.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.325 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.621 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.11 -38.69 15.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 118.316 -0.85 . . . . 0.0 110.264 178.893 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.3 m-20 148.98 33.84 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.0 t -151.08 88.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 121.821 -0.55 . . . . 0.0 112.429 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.037 ' O ' HD12 ' A' ' 24' ' ' ILE . 63.4 m-80 -70.04 60.82 0.18 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.3 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.037 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 40.65 -11.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 118.539 2.792 . . . . 0.0 118.539 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -38.1 -62.05 0.6 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.773 1.17 . . . . 0.0 110.787 -177.619 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.02 -30.97 40.59 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.231 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.537 ' HB3' HG22 ' A' ' 24' ' ' ILE . 2.8 tp -60.27 -61.68 2.42 Favored 'General case' 0 C--N 1.338 0.074 0 O-C-N 122.916 -0.167 . . . . 0.0 111.001 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.084 HG22 ' CG2' ' B' ' 128' ' ' VAL . 37.2 t -45.66 -66.31 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.063 0.459 . . . . 0.0 110.986 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 15.3 p -49.39 -44.08 44.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.408 ' O ' ' HG2' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -72.72 -44.85 61.19 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.177 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 m -54.42 -38.16 65.93 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.559 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.825 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 5.5 mmt -56.34 -57.38 12.52 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.58 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 30' ' ' THR . 4.5 pt20 -50.44 -38.63 44.45 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.74 0.305 . . . . 0.0 111.317 -179.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -69.88 -51.67 31.23 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.431 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.689 ' HB3' HD21 ' B' ' 117' ' ' LEU . 4.5 tp10 -68.72 -23.11 64.32 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.273 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.782 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -79.31 -46.02 18.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.572 0.349 . . . . 0.0 110.689 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.27 -50.8 68.71 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.913 0.863 . . . . 0.0 109.971 178.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.973 0 CA-C-N 113.392 -1.731 . . . . 0.0 113.486 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.487 ' O ' ' HG2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 8' ' ' THR . 7.6 tt0 -100.34 113.28 25.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.591 178.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.445 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 4.5 ttm180 -78.38 101.11 7.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.218 0.532 . . . . 0.0 110.607 -179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.748 HG12 HG13 ' A' ' 7' ' ' VAL . 0.6 OUTLIER -99.36 118.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.41 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.731 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -123.22 123.21 40.26 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.152 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.78 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.45 103.33 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 175.511 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.932 HG22 ' HG3' ' A' ' 4' ' ' ARG . 64.9 p -70.06 67.9 0.3 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.652 0.739 . . . . 0.0 109.751 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.035 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.0 p -70.31 -130.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 114.13 -1.396 . . . . 0.0 111.831 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.736 ' H ' HG22 ' B' ' 109' ' ' VAL . 25.9 t70 84.89 -5.38 0.95 Allowed 'General case' 0 N--CA 1.485 1.292 0 CA-C-N 119.893 1.224 . . . . 0.0 109.603 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.29 -64.54 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.642 177.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.81 -84.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.265 -179.816 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.96 44.29 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.132 0.491 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.035 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.35 -44.83 14.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.566 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.6 mp0 -48.85 -38.95 23.85 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.782 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.17 -56.72 9.84 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.727 0.694 . . . . 0.0 111.761 179.516 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.772 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.9 OUTLIER -58.33 -48.51 80.31 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.034 -179.005 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -73.41 -26.33 60.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.287 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.91 -25.25 42.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.874 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.619 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.4 m-30 -87.97 -51.72 5.66 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.6 m-20 144.45 48.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 O-C-N 124.36 1.038 . . . . 0.0 112.096 177.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.772 ' CG1' HD12 ' B' ' 117' ' ' LEU . 5.3 p -150.69 85.76 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.017 ' O ' HD12 ' B' ' 124' ' ' ILE . 43.1 m-80 -68.3 59.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.734 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.017 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.8 OUTLIER 37.42 1.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 178.253 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.09 -62.35 0.57 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.584 1.083 . . . . 0.0 110.373 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -83.33 -31.87 26.87 Favored Glycine 0 C--O 1.223 -0.574 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.169 178.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.769 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.66 -62.02 2.02 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.795 0.438 . . . . 0.0 111.888 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.084 ' CG2' HG22 ' A' ' 28' ' ' VAL . 1.8 t -52.34 -64.7 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.145 0.497 . . . . 0.0 110.929 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.731 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 84.6 p -50.46 -41.63 53.21 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.816 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.425 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 7.6 m -65.7 -51.88 55.8 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.1 -38.52 62.65 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.879 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.889 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.2 mtt -58.11 -55.52 33.83 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.974 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.579 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -50.57 -39.98 51.04 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.21 0.459 . . . . 0.0 111.115 179.29 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -68.79 -52.54 29.19 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.663 0.268 . . . . 0.0 110.754 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 1.006 ' HB3' HD21 ' A' ' 17' ' ' LEU . 22.6 tp10 -68.76 -22.03 64.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.208 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.606 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -80.08 -46.77 15.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.424 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -53.31 59.09 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 121.581 0.705 . . . . 0.0 110.325 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.44 -0.933 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.166 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.5 mttp . . . . . 0 N--CA 1.467 0.405 0 CA-C-O 120.919 0.39 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.604 ' HG2' ' CE2' ' B' ' 114' ' ' TYR . 5.0 tp60 -69.58 115.15 8.49 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.138 0.494 . . . . 0.0 110.211 178.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -78.1 99.23 6.07 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.778 0.799 . . . . 0.0 109.072 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.818 HD11 HG11 ' A' ' 28' ' ' VAL . 1.9 pt -99.34 120.22 48.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 107.022 -1.474 . . . . 0.0 107.022 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.66 126.21 34.07 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 118.755 -1.178 . . . . 0.0 114.129 -176.661 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.486 ' O ' HG22 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -99.45 109.47 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 175.869 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.406 HG23 ' NH1' ' B' ' 104' ' ' ARG . 1.6 p -70.67 94.77 1.04 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.865 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -99.59 -120.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.368 -177.803 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 4.7 t70 97.32 11.85 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 CA-C-O 122.088 0.946 . . . . 0.0 109.144 -175.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -170.69 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.386 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.748 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 0.0 OUTLIER -68.74 49.97 0.07 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -176.491 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.677 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.6 OUTLIER 52.26 12.59 0.23 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.448 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.876 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -67.17 -57.4 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.535 0.683 . . . . 0.0 112.159 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.808 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 6.6 mt-30 -50.29 -28.71 8.27 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -62.76 -57.17 11.87 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.416 0.553 . . . . 0.0 111.655 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.977 HD23 ' CE2' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -47.26 -48.56 24.54 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.89 0.852 . . . . 0.0 111.9 -179.187 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.71 ' CB ' ' HA ' ' A' ' 23' ' ' ASN . 3.5 pttt -79.27 -26.41 42.36 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.682 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.7 -22.96 63.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.005 179.039 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.977 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.01 -41.24 13.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.871 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 167.12 -12.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 177.045 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.594 ' O ' ' N ' ' A' ' 24' ' ' ILE . 75.2 t -109.6 80.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-O 120.539 0.209 . . . . 0.0 111.206 -178.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.074 ' C ' HD12 ' A' ' 24' ' ' ILE . 61.6 m-80 -63.4 60.69 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.185 0.517 . . . . 0.0 111.036 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.074 HD12 ' C ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER 46.01 -21.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 178.597 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.765 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.28 -63.8 0.47 Allowed 'General case' 0 C--O 1.245 0.862 0 CA-C-N 118.534 0.606 . . . . 0.0 112.21 -173.999 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.04 -14.26 72.58 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.29 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.779 HD12 HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -65.97 -61.26 2.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 122.343 0.257 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.966 HG23 HG22 ' A' ' 24' ' ' ILE . 55.7 t -51.09 -59.21 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.693 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 25.7 p -49.35 -36.81 22.58 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.532 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -74.31 -56.08 5.29 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.491 HG23 HD21 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -56.05 -44.37 78.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.696 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.862 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.6 mmt -52.57 -46.12 66.75 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.707 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.455 ' N ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.831 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -60.49 -51.81 67.87 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.684 ' HG3' HD11 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -63.45 -34.08 76.97 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.503 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.678 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -67.17 -45.39 77.12 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.999 0.428 . . . . 0.0 109.906 177.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -53.56 56.68 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.61 0.719 . . . . 0.0 109.986 178.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.444 -0.769 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.123 -178.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.238 0 CA-C-O 120.736 0.303 . . . . 0.0 110.503 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.644 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 14.4 tt0 -125.93 120.16 29.67 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.554 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 7.6 ttm-85 -79.69 116.6 19.97 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.197 -178.415 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.901 HD13 HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -113.36 129.77 68.53 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 176.424 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.716 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -129.12 131.7 47.27 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.262 -0.975 . . . . 0.0 112.461 -178.395 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.765 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.96 91.14 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 23.8 p -69.13 67.54 0.17 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 122.258 1.027 . . . . 0.0 109.735 -178.166 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.73 HG12 HG12 ' B' ' 107' ' ' VAL . 15.0 p -99.72 -129.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 113.717 -1.583 . . . . 0.0 110.623 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.701 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER 161.52 -84.84 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.008 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.453 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 45.2 t -102.8 11.25 37.81 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.815 -0.612 . . . . 0.0 112.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 3.1 t0 -79.24 61.32 3.31 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-N 119.785 1.175 . . . . 0.0 108.105 179.09 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' ' 29' ' ' SER . 66.0 m 63.33 -22.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.995 -1.002 . . . . 0.0 113.146 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.797 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -47.02 -59.53 3.06 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-O 121.14 0.495 . . . . 0.0 110.852 179.399 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.649 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.8 pt20 -48.49 -38.86 21.23 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.927 -177.546 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.678 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -55.98 -41.38 74.71 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.343 0.52 . . . . 0.0 112.051 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.849 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -64.62 -45.97 84.62 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.006 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.797 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -74.55 -26.05 59.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 178.782 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -65.46 -34.27 77.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.531 178.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.707 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.21 -26.87 22.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.661 179.134 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.586 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 31.1 t70 124.76 61.32 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 121' ' ' ASP . 24.2 t -156.0 -47.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.536 ' CG ' ' HB3' ' B' ' 118' ' ' LYS . 12.8 m-80 68.69 -112.55 0.11 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 -176.005 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.982 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -150.02 1.69 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 177.725 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.421 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.89 -63.44 0.59 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.798 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.37 -30.04 20.39 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.071 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.786 HD22 ' HG ' ' B' ' 117' ' ' LEU . 10.5 tp -56.51 -61.6 2.3 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.624 0.212 . . . . 0.0 110.441 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.982 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -48.76 -60.12 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.748 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 2.2 t -49.0 -46.56 44.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -51.51 39.39 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 23.5 m -59.6 -36.02 75.46 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.584 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.958 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 1.9 mmt -62.9 -57.9 9.23 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.219 -179.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 1.0 OUTLIER -54.49 -33.46 59.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.512 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.04 -52.35 11.28 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' A' ' 17' ' ' LEU . 78.7 mm-40 -71.25 -20.99 62.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.012 0.434 . . . . 0.0 110.363 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.05 -31.88 34.28 Favored 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 123.122 0.569 . . . . 0.0 110.84 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -80.28 -52.55 7.58 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.58 0.705 . . . . 0.0 110.68 179.535 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 . . . . . 0 N--CA 1.445 -0.705 0 CA-C-N 114.489 -1.232 . . . . 0.0 112.704 -177.616 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.563 ' HE3' ' HA ' ' B' ' 109' ' ' VAL . 1.7 mmmt . . . . . 0 CA--C 1.54 0.567 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.844 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 2.8 tp60 -135.79 138.6 42.77 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.186 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.953 ' HG3' HG22 ' B' ' 108' ' ' THR . 8.1 ttm-85 -81.6 98.07 8.17 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.648 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.686 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -97.65 109.62 23.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.753 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.4 OUTLIER -116.95 121.59 41.86 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.921 -177.193 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.883 HG23 HD13 ' B' ' 124' ' ' ILE . 0.8 OUTLIER -98.96 102.55 13.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 176.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 5.9 p -70.15 67.38 0.3 Allowed 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.941 HG13 ' H ' ' A' ' 10' ' ' ASP . 13.4 p -97.95 -101.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.941 ' H ' HG13 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 70.91 -61.68 0.47 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 104.195 -2.52 . . . . 0.0 104.195 -174.284 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.561 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -36.58 -70.22 0.1 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 112.83 -1.987 . . . . 0.0 108.804 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.79 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -63.62 -61.54 2.25 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 -175.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 171.7 37.31 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 120.186 1.357 . . . . 0.0 113.347 -179.328 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.925 ' CE1' HD13 ' B' ' 105' ' ' ILE . 1.2 t80 -81.32 -50.5 9.43 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.44 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.611 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.1 mm-40 -49.88 -30.12 9.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -176.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.705 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.8 mt -55.5 -59.06 5.36 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.074 0.397 . . . . 0.0 111.306 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.767 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -55.17 -51.26 67.09 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.76 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.538 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -72.25 -25.95 61.82 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.234 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -58.39 -28.87 65.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.433 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.598 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.4 m-30 -88.09 -42.2 12.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.598 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 149.21 1.82 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 O-C-N 124.294 0.997 . . . . 0.0 112.347 178.455 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.578 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 16.5 t -94.05 71.46 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 121.938 -0.476 . . . . 0.0 112.12 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.958 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -61.43 47.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.958 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 40.33 -4.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 178.756 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.526 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -40.86 -55.97 2.33 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 120.066 1.303 . . . . 0.0 110.973 -178.707 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -28.1 24.45 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.499 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -63.45 -64.33 0.93 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 117.325 0.562 . . . . 0.0 110.143 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.75 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.7 t -51.3 -61.22 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.695 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 9.3 p -48.68 -27.24 2.74 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.134 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.2 m -83.25 -53.28 5.88 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.524 HG21 HD21 ' B' ' 127' ' ' LEU . 10.2 m -55.33 -50.82 68.64 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.642 0.734 . . . . 0.0 109.201 178.292 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.963 ' HE1' HG23 ' B' ' 124' ' ' ILE . 5.3 mmt -48.89 -50.08 36.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.526 -1.216 . . . . 0.0 111.955 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.496 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.93 -47.26 85.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.499 0.19 . . . . 0.0 110.922 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 72.4 m-20 -58.16 -53.97 52.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.765 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' HD21 ' B' ' 117' ' ' LEU . 27.6 mm-40 -69.25 -30.92 69.15 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.399 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -68.34 -30.64 69.66 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.241 0.543 . . . . 0.0 109.668 177.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 3.0 mmt180 -82.4 -52.15 7.17 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.922 0.867 . . . . 0.0 110.104 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 113.593 -1.639 . . . . 0.0 114.007 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.431 ' HE3' ' HB2' ' A' ' 11' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.49 0 CA-C-O 120.674 0.273 . . . . 0.0 110.74 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.73 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 9.8 tt0 -135.45 134.64 39.81 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.481 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 8.6 ttm105 -79.56 116.19 19.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.287 0.565 . . . . 0.0 110.033 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.925 HD13 ' CE1' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -115.4 116.37 52.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.405 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -121.05 127.16 51.44 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -175.975 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.742 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -103.73 95.64 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.953 HG22 ' HG3' ' A' ' 4' ' ' ARG . 52.8 p -70.9 91.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.938 -1.101 . . . . 0.0 109.93 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.833 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 4.4 m -132.4 -30.17 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -177.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.844 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 7.9 t70 42.38 -88.1 0.01 OUTLIER 'General case' 0 C--N 1.343 0.302 0 CA-C-O 122.451 1.12 . . . . 0.0 108.721 -177.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.577 ' N ' ' O ' ' B' ' 109' ' ' VAL . 2.0 m -60.81 -18.31 54.66 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 112.542 -2.117 . . . . 0.0 114.991 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.833 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -79.5 62.3 3.78 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 120.194 1.361 . . . . 0.0 110.374 -178.572 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 29' ' ' SER . 17.0 m 57.98 -19.73 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.686 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -47.08 -54.24 10.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.496 0.665 . . . . 0.0 110.663 179.301 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.7 pt20 -50.18 -43.85 52.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.717 -1.128 . . . . 0.0 112.614 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.684 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -56.56 -45.16 81.41 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 120.874 0.369 . . . . 0.0 111.864 -179.476 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.98 ' CD1' HD12 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -55.14 -47.62 74.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.774 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -79.25 -33.14 43.8 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.205 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.15 66.51 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.914 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.644 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.67 -43.33 11.4 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.447 178.976 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 151.55 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 177.026 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.658 HG12 HD13 ' B' ' 117' ' ' LEU . 88.6 t -162.07 88.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.774 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -61.93 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.02 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -151.12 -0.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 178.453 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 8.7 t -38.71 -62.39 0.62 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.69 0.281 . . . . 0.0 110.63 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.415 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.99 -28.62 30.77 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.98 HD12 ' CD1' ' B' ' 117' ' ' LEU . 1.2 tt -62.61 -61.91 2.1 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.845 0.322 . . . . 0.0 110.902 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.02 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.9 t -53.09 -61.35 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.822 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.79 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 16.1 p -49.56 -45.58 47.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.5 OUTLIER -83.57 -50.68 8.0 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.806 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.575 ' HB ' HD23 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -54.47 -34.52 61.71 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.984 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.767 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.6 mmt -66.55 -52.52 44.78 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.054 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -42.06 61.35 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 122.143 -0.348 . . . . 0.0 111.191 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.3 m-20 -64.38 -55.68 19.42 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.858 0.361 . . . . 0.0 110.173 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -23.06 65.65 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.693 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.705 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -72.07 -40.14 68.5 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -52.85 14.12 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.842 0.83 . . . . 0.0 109.521 177.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.445 -0.684 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.027 -177.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.43 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 4.2 mpp? . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.449 0.166 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.737 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 17.9 mmtm 71.82 140.73 0.05 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.834 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.504 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 56.0 tt0 -112.35 120.4 41.56 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.205 0.526 . . . . 0.0 111.858 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.017 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -77.9 109.1 11.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.999 0.904 . . . . 0.0 111.798 -179.013 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.823 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -110.65 117.16 54.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.379 178.514 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.876 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -133.1 134.37 44.17 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 118.262 -1.375 . . . . 0.0 114.48 -177.735 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.874 HG12 HD13 ' B' ' 124' ' ' ILE . 1.4 m -99.72 111.68 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.969 HG23 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -71.6 67.85 0.56 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.013 -0.43 . . . . 0.0 111.975 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.806 HG22 HG22 ' A' ' 7' ' ' VAL . 3.2 m -99.03 -120.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.721 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.687 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 6.1 t70 157.61 -85.09 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.721 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -102.04 12.36 36.97 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 119.237 -0.411 . . . . 0.0 112.094 178.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.537 ' C ' ' H ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -73.43 60.39 0.63 Allowed 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.355 0.98 . . . . 0.0 108.47 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.558 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 48.8 m 61.52 -23.54 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.737 ' CG ' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -48.5 -60.63 2.53 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 123.173 0.589 . . . . 0.0 111.07 179.722 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.721 ' HG2' ' HA ' ' A' ' 11' ' ' SER . 0.8 OUTLIER -48.95 -36.94 18.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.804 -176.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.57 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.34 -49.52 77.5 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.915 ' CD1' HD22 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -51.57 -56.33 14.11 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.417 0.627 . . . . 0.0 111.653 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 4.7 pttt -70.43 -28.38 64.99 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.72 -26.0 68.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.677 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.985 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -87.76 -41.18 13.48 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.98 178.922 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.558 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 157.18 35.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 177.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.597 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -167.56 96.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 122.149 0.975 . . . . 0.0 113.527 -179.599 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.968 ' O ' HD12 ' A' ' 24' ' ' ILE . 34.1 m-80 -67.26 66.23 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.134 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.968 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER 36.34 -6.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -38.36 -61.74 0.66 Allowed 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.569 1.077 . . . . 0.0 111.559 -177.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.83 -33.27 34.2 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.294 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.948 HD23 ' CG2' ' A' ' 24' ' ' ILE . 22.4 tp -62.36 -61.97 2.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 117.367 0.584 . . . . 0.0 111.707 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.794 HG23 ' CG2' ' A' ' 24' ' ' ILE . 17.6 t -46.15 -68.54 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 O-C-N 123.381 0.425 . . . . 0.0 110.204 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.583 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 2.9 m -49.96 -37.01 30.2 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -64.13 -51.41 64.06 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.2 m -60.99 -39.85 91.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.057 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.847 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 6.0 mmt -58.41 -57.77 11.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.817 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.417 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -52.79 -35.4 56.69 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.998 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -70.65 -55.87 7.75 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.61 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.962 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -69.75 -17.53 63.44 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 177.68 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -75.83 -50.54 14.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -56.49 10.03 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.12 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -62.72 -47.82 81.9 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.47 -179.016 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 37.44 37.95 0.12 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.04 179.565 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.537 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -177.98 109.99 0.06 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.506 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 79.59 96.19 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 175.52 4.55 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.927 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.22 118.45 22.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.093 0.473 . . . . 0.0 111.671 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -122.21 176.23 5.96 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.75 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.594 ' HD2' ' CD ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -165.2 135.2 3.66 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.978 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.543 HG13 ' O ' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -160.42 104.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -108.73 -67.05 1.0 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -133.14 138.0 46.47 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.599 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.597 ' C ' ' HG3' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -72.12 79.52 0.95 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.012 0.434 . . . . 0.0 110.842 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.597 ' HG3' ' C ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 41.06 -94.77 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.953 -179.166 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.12 22.28 59.42 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 tpp 72.25 -53.12 0.7 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 122.622 0.369 . . . . 0.0 111.844 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.8 m -78.02 142.54 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -131.12 -168.67 2.04 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.96 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.521 HG23 ' H ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -152.6 -61.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.63 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . . . 68.1 97.81 0.06 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.291 0.567 . . . . 0.0 111.362 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.502 ' NH1' HG21 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -103.43 -27.43 12.41 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.929 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -160.88 -170.73 2.82 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.324 0.583 . . . . 0.0 112.443 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.84 HD13 HG13 ' B' ' 146' ' ' VAL . 1.3 pp -96.69 149.64 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.217 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.433 ' HG2' ' HE3' ' A' ' 45' ' ' LYS . 2.1 tt0 -144.53 -56.51 0.35 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.736 ' HA ' ' HB3' ' B' ' 147' ' ' GLU . 2.0 mtt -149.67 153.39 36.92 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.554 0.216 . . . . 0.0 111.306 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.492 ' ND2' ' HG3' ' B' ' 147' ' ' GLU . 10.7 p30 -110.62 156.42 20.99 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.782 0.325 . . . . 0.0 110.96 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.416 ' O ' ' CB ' ' A' ' 64' ' ' SER . . . -136.36 -44.07 0.1 OUTLIER Glycine 0 C--N 1.337 0.589 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.975 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 63' ' ' GLY . 6.1 t 84.6 -166.45 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.563 0.345 . . . . 0.0 110.772 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 54.99 -102.33 0.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.595 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -158.02 64.47 0.46 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.369 0.604 . . . . 0.0 111.448 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.608 ' HB3' ' CZ ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -155.38 -61.59 0.11 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.231 -179.246 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 61.18 173.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.571 ' HA ' ' HG2' ' B' ' 138' ' ' ARG . 0.6 OUTLIER -132.53 87.2 2.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.021 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 56' ' ' ALA . 19.0 mtpt -96.31 167.4 11.21 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.994 0.425 . . . . 0.0 111.605 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 72' ' ' TRP . 8.7 p-10 -93.7 116.2 28.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.172 0.51 . . . . 0.0 111.569 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.449 ' HB3' ' O ' ' A' ' 71' ' ' ASP . 24.9 p-90 . . . . . 0 C--O 1.251 1.15 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.263 179.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 120.196 0.046 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp -76.44 157.46 32.21 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.101 0.251 . . . . 0.0 110.486 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.687 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 4.9 tt0 -113.59 116.51 29.62 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.278 0.561 . . . . 0.0 111.753 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.969 ' CZ ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -79.07 113.92 17.6 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.653 178.34 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.737 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -106.05 122.65 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.755 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.876 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -125.45 123.78 39.99 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.469 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.823 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.8 104.1 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 173.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 108' ' ' THR . . . . . 1.017 HG22 ' HG3' ' A' ' 4' ' ' ARG . 55.2 p -70.24 89.79 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.826 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.5 t -82.75 -131.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.0 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.737 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 22.3 t0 86.34 -3.39 0.73 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -175.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.5 m -137.04 -59.27 0.7 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.514 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.583 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -46.15 -91.6 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.5 OUTLIER 179.11 36.53 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.528 -0.733 . . . . 0.0 110.63 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.936 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -82.24 -46.16 14.07 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -178.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.562 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.82 -34.73 12.97 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.772 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -59.85 -56.93 15.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.424 0.556 . . . . 0.0 112.288 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.962 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -53.46 -40.61 65.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 119.856 -0.737 . . . . 0.0 111.495 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.659 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -79.15 -26.89 42.72 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 0.0 110.196 178.29 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -62.03 -29.82 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.738 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.753 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -88.0 -44.07 11.27 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.708 178.428 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.705 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 t0 160.21 15.82 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 177.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.469 ' O ' HD23 ' B' ' 117' ' ' LEU . 60.9 t -154.28 93.35 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-N 118.848 0.749 . . . . 0.0 112.938 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.606 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.3 m120 -56.58 -97.64 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.73 -1.28 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.9 OUTLIER -39.27 -64.47 0.46 Allowed 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.202 -177.823 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.22 -26.63 35.99 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 121.1 -0.572 . . . . 0.0 112.449 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.728 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.79 -61.09 2.75 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.065 0.46 . . . . 0.0 110.641 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.19 HG13 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -49.03 -66.38 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.965 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.584 ' N ' HG12 ' B' ' 128' ' ' VAL . 94.9 p -49.27 -35.22 17.23 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 29.0 m -70.76 -53.72 14.43 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.447 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -62.55 -41.0 98.61 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.111 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.19 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -56.72 -51.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.325 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.558 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -55.81 -39.3 71.16 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 121.024 -0.271 . . . . 0.0 111.09 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -47.46 65.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.99 -27.82 68.42 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.025 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.597 ' O ' ' HB2' ' B' ' 139' ' ' LEU . . . -74.13 -52.33 12.88 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 122.919 0.487 . . . . 0.0 110.607 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.482 ' HA ' ' HD2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -54.16 -50.49 66.87 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.417 0.627 . . . . 0.0 110.724 178.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.594 ' CD ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.73 -32.97 64.12 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.964 -1.016 . . . . 0.0 112.561 -177.782 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.985 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -10.49 100.69 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -153.99 76.39 1.06 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.13 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -33.64 112.75 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.166 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -167.34 -173.53 2.29 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.224 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.443 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -160.55 175.25 12.92 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.952 179.301 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.405 ' O ' ' HE3' ' B' ' 145' ' ' LYS . 1.2 m-90 63.05 71.87 0.5 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.28 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.443 ' NZ ' ' O ' ' B' ' 143' ' ' ARG . 0.2 OUTLIER -150.62 138.05 19.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.84 HG13 HD13 ' A' ' 59' ' ' ILE . 3.2 p -106.49 173.39 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.849 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.736 ' HB3' ' HA ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -137.06 163.07 31.63 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.213 0.53 . . . . 0.0 112.222 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 179.36 53.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.987 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -157.95 157.87 33.9 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.83 0.348 . . . . 0.0 111.492 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -93.13 158.4 15.79 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.227 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -125.67 96.3 0.49 Allowed Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.327 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.561 ' O ' ' HB ' ' B' ' 153' ' ' VAL . 2.2 ttt -110.78 -141.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.071 0.148 . . . . 0.0 111.024 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' B' ' 152' ' ' MET . 50.7 t 80.96 143.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.06 0.544 . . . . 0.0 111.579 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.522 ' HB3' ' HB2' ' B' ' 172' ' ' TRP . 4.9 mp0 -132.68 164.52 26.55 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.425 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.468 HG22 ' O ' ' B' ' 155' ' ' VAL . 13.0 p 178.72 54.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.509 0.671 . . . . 0.0 111.803 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.423 ' HB2' ' HD1' ' B' ' 172' ' ' TRP . . . -73.87 159.03 33.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.965 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.89 143.67 26.39 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.174 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -106.39 110.27 22.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.848 0.356 . . . . 0.0 111.201 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.402 HG23 ' HG2' ' B' ' 160' ' ' GLU . 0.0 OUTLIER -174.49 -41.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.676 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.402 ' HG2' HG23 ' B' ' 159' ' ' ILE . 34.7 mm-40 -83.57 -77.94 0.24 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.377 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 4.4 ttm -178.64 -67.94 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.429 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 49.54 59.41 4.51 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.153 0.502 . . . . 0.0 111.986 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -84.2 61.86 4.66 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.034 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 25.2 p -98.55 84.42 3.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 120.93 0.395 . . . . 0.0 110.513 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.77 129.67 56.73 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.906 -179.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.56 ' HB1' ' HB3' ' B' ' 121' ' ' ASP . . . -162.35 -116.86 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.694 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -70.7 83.09 0.62 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.909 0.385 . . . . 0.0 111.504 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 37.7 46.44 0.72 Allowed 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.801 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -101.78 163.61 12.17 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.246 0.546 . . . . 0.0 112.024 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.81 165.76 22.64 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.665 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -60.53 166.88 2.89 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.003 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.522 ' HB2' ' HB3' ' B' ' 154' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.978 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.542 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.686 H5'' ' N3 ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.163 0 C3'-C2'-C1' 105.346 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.787 H2'' " O5'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 105.978 2.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.787 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 104.274 1.124 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.475 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.997 0 C1'-O4'-C4' 107.478 -1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.714 " H2'" ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C3'-C2'-C1' 105.199 1.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.853 ' H71' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.513 0 C4'-C3'-C2' 103.76 0.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.528 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C3'-C2'-C1' 105.892 2.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.518 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C3'-C2'-C1' 101.434 -0.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.482 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 104.311 1.151 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.494 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.978 0 C3'-C2'-C1' 105.125 1.732 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.494 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.708 0 N19-C1'-C2' 113.131 -0.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 C1'-O4'-C4' 110.478 0.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-C2' 107.074 0.886 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 O4'-C1'-C2' 107.224 1.022 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.641 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 102.046 -0.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.674 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.637 -0.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.674 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.864 0 C4'-C3'-C2' 104.537 1.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.527 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.92 0 C4'-C3'-C2' 104.813 1.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.713 ' H72' ' CG2' ' B' ' 106' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.837 0 C1'-O4'-C4' 106.839 -2.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.526 ' C8 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C3'-C2'-C1' 104.484 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.815 0 C4'-C3'-C2' 104.691 1.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.585 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-C2' 107.061 0.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.585 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.061 0 C1'-O4'-C4' 107.18 -1.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.433 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C4'-C3'-C2' 104.532 1.332 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.404 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.691 0 C4'-C3'-C2' 104.427 1.227 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 102.037 -0.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpp? . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.312 0.101 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.16 129.1 9.5 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.111 0.482 . . . . 0.0 111.71 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.615 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 34.4 tp60 -111.36 119.48 38.99 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.742 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.919 ' HG3' HG22 ' B' ' 108' ' ' THR . 9.0 ttp-105 -78.17 107.92 11.1 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.327 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.793 HD11 HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -109.33 116.47 52.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.128 178.788 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -121.51 124.03 43.43 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 119.8 -0.76 . . . . 0.0 112.921 -177.414 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.792 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.69 108.44 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.688 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.494 ' HB ' ' CG ' ' B' ' 102' ' ' LYS . 11.4 p -70.5 88.73 0.68 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.156 0.503 . . . . 0.0 110.54 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.148 HG21 ' CD1' ' A' ' 14' ' ' TYR . 15.8 m -81.9 -146.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.852 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.692 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 4.3 t70 87.82 -10.97 0.52 Allowed 'General case' 0 C--N 1.353 0.721 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -176.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 t -116.53 -69.84 0.83 Allowed 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.373 177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -51.68 -86.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.664 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.645 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 0.4 OUTLIER 178.77 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 120.416 1.462 . . . . 0.0 112.997 -178.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.148 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -82.96 -41.06 19.25 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.33 0.652 . . . . 0.0 112.615 179.429 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 1.5 mp0 -49.11 -42.91 40.74 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -175.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.717 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -55.26 -42.71 73.86 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.469 1.031 . . . . 0.0 112.445 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.949 HD12 ' HG2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -63.37 -55.12 27.08 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.108 -179.079 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -67.77 -26.0 65.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.495 0.664 . . . . 0.0 110.015 178.442 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -61.45 -31.77 71.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.594 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.902 ' CE2' HD21 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.5 -42.52 12.05 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 118.396 -0.811 . . . . 0.0 109.995 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 152.88 26.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.499 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.421 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.3 t -156.43 91.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 O-C-N 122.106 -0.371 . . . . 0.0 111.904 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -54.78 -92.01 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.952 HG21 HG22 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -153.84 1.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 115.874 1.805 . . . . 0.0 115.874 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.844 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.3 p -38.97 -63.72 0.51 Allowed 'General case' 0 C--O 1.246 0.915 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.236 -177.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.86 -23.39 52.89 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.443 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.943 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -65.12 -60.88 2.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.825 0.313 . . . . 0.0 111.111 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.812 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.7 t -50.44 -65.28 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.401 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.651 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 12.9 p -48.62 -36.1 15.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.3 m -78.04 -52.28 9.02 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.667 HG23 HD21 ' B' ' 127' ' ' LEU . 0.7 OUTLIER -60.51 -41.15 93.75 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.605 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.795 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.2 mmt -54.87 -47.02 74.76 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.526 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.4 tt0 -60.46 -52.6 64.5 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.7 0.286 . . . . 0.0 110.805 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -48.1 76.41 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.014 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.586 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -69.8 -33.07 71.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.147 178.02 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.686 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -64.56 -45.71 85.89 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.513 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -62.26 -51.33 68.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.332 177.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' B' ' 170' ' ' LYS . 2.0 tpm_? -58.34 -43.96 88.5 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.429 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.4 OUTLIER -13.94 110.91 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.835 0.854 . . . . 0.0 112.503 179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -134.4 -85.3 0.42 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 40' ' ' ARG . . . 168.88 162.1 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.84 0.352 . . . . 0.0 111.553 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.59 93.27 0.9 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.094 0.473 . . . . 0.0 110.914 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' HA ' ' NE ' ' A' ' 43' ' ' ARG . 3.6 tpm_? -103.82 -12.86 16.66 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.883 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.2 t90 69.5 -59.05 0.5 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.453 ' O ' ' HB ' ' A' ' 46' ' ' VAL . 0.6 OUTLIER -140.59 149.77 42.77 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.345 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.453 ' HB ' ' O ' ' A' ' 45' ' ' LYS . 36.7 t 84.0 111.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.914 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -109.81 -162.63 0.81 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.613 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -166.07 138.86 4.05 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.793 0.33 . . . . 0.0 111.609 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.53 59.89 0.85 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.356 0.598 . . . . 0.0 110.828 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -106.88 58.71 0.63 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.658 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -174.16 -36.56 0.04 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 120.478 -0.867 . . . . 0.0 114.37 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.6 mmt 72.23 173.9 0.3 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 117.332 0.566 . . . . 0.0 111.229 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.417 HG23 ' CG ' ' A' ' 54' ' ' GLU . 7.3 m -120.39 -169.08 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HG2' ' CZ3' ' A' ' 72' ' ' TRP . 11.5 mt-10 72.59 141.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.282 0.563 . . . . 0.0 111.43 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 55' ' ' VAL . 11.4 p -134.96 31.04 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.021 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.56 61.81 0.24 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.247 0.546 . . . . 0.0 110.31 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' NH1' ' HA ' ' A' ' 55' ' ' VAL . 31.3 ptt-85 -164.22 44.17 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.246 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.78 -66.76 0.14 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.648 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -151.32 141.69 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 120.929 0.395 . . . . 0.0 111.371 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -75.78 167.42 21.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.331 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.99 127.01 30.1 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.232 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -84.9 -53.05 5.57 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.581 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.52 112.89 1.18 Allowed Glycine 0 C--N 1.336 0.582 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.124 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.9 t -137.99 153.21 49.44 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 111.709 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -85.72 -9.75 56.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.182 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -126.56 97.24 4.95 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.531 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.449 ' HB3' ' O ' ' A' ' 66' ' ' ALA . 45.2 t0 82.92 143.29 0.07 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.423 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -91.39 -67.45 0.85 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.981 179.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.19 -178.87 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.522 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.445 ' NZ ' HG11 ' A' ' 55' ' ' VAL . 0.0 OUTLIER 65.14 96.86 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.39 -179.74 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -58.37 -57.05 14.61 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.575 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.49 ' CB ' HG12 ' A' ' 55' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.735 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.433 ' O ' ' C ' ' B' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -27.37 119.57 0.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 O-C-N 123.567 0.542 . . . . 0.0 112.319 -178.7 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.505 ' HB3' HG23 ' A' ' 9' ' ' VAL . 24.9 tt0 -98.67 114.11 26.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.651 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.525 ' NE ' ' O4 ' ' D' ' 193' ' ' ' DT' . 14.7 ttm-85 -78.29 105.35 9.47 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.401 0.619 . . . . 0.0 112.233 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.792 HG12 HG13 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -106.63 126.4 62.47 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 176.293 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.694 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -124.44 127.81 48.07 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 119.94 -0.704 . . . . 0.0 112.154 -177.72 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.844 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.2 t -100.14 93.85 3.2 Favored 'Isoleucine or valine' 0 C--N 1.346 0.44 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.919 HG22 ' HG3' ' A' ' 4' ' ' ARG . 73.3 p -70.62 66.87 0.35 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.811 0.815 . . . . 0.0 109.434 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.754 HG12 HG12 ' B' ' 107' ' ' VAL . 7.5 p -90.55 -124.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 CA-C-N 113.905 -1.498 . . . . 0.0 108.816 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.646 ' H ' HG22 ' B' ' 109' ' ' VAL . 21.7 t70 158.41 -92.22 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.652 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 26.5 t -97.61 9.57 42.16 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.226 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.71 ' HB2' ' CG2' ' B' ' 109' ' ' VAL . 52.8 m-20 -80.37 68.91 6.7 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 117.794 -1.563 . . . . 0.0 108.242 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.758 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 61.97 -24.3 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.167 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.643 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -48.69 -62.36 1.55 Allowed 'General case' 0 C--N 1.348 0.506 0 CA-C-O 120.895 0.379 . . . . 0.0 111.313 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.652 ' HG2' ' HA ' ' B' ' 111' ' ' SER . 0.8 OUTLIER -49.85 -34.56 20.26 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.134 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.686 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -59.75 -56.1 26.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.832 HD21 HD13 ' B' ' 127' ' ' LEU . 0.1 OUTLIER -54.04 -44.46 71.05 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 120.412 -0.515 . . . . 0.0 112.226 -177.963 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.712 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER -70.57 -25.66 63.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 178.664 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.576 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -63.88 -28.02 69.56 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.02 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.804 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -88.35 -41.4 12.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.749 -1.119 . . . . 0.0 110.715 178.726 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.641 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 m-20 146.42 45.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.503 HG21 ' HB3' ' B' ' 166' ' ' ALA . 25.7 t -150.9 -43.85 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.712 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 5.2 m-80 73.06 -121.09 0.05 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.143 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -138.3 0.26 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 C-N-CA 119.515 -0.874 . . . . 0.0 113.308 177.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.438 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.65 -63.14 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.094 0.473 . . . . 0.0 109.784 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.636 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -88.21 -33.98 10.13 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.329 178.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.832 HD13 HD21 ' B' ' 117' ' ' LEU . 9.1 tp -54.65 -62.35 1.71 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 117.149 0.475 . . . . 0.0 111.168 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.143 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.9 t -52.07 -62.34 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.313 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 20.9 p -52.46 -44.31 65.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.636 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -73.22 -49.14 29.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' B' ' 135' ' ' GLU . 2.8 m -53.72 -52.25 60.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.963 ' SD ' HG13 ' B' ' 128' ' ' VAL . 8.9 mtt -55.37 -53.77 51.98 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -52.58 -42.59 64.65 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.443 179.519 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -65.64 -54.45 27.48 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.557 ' O ' ' HG ' ' B' ' 139' ' ' LEU . 6.7 mm-40 -60.65 -28.05 68.28 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.717 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -76.02 -50.91 13.51 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.602 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -49.16 62.51 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.964 0.888 . . . . 0.0 109.529 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' B' ' 140' ' ' ARG . 3.6 mmt180 -69.96 -16.78 63.25 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.579 -1.646 . . . . 0.0 113.412 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.902 HD21 ' CE2' ' A' ' 20' ' ' TYR . 47.3 mt -43.48 82.56 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER 171.83 105.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.71 179.732 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 68.66 0.26 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.024 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.73 -49.49 10.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.847 0.356 . . . . 0.0 110.262 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -136.52 -176.82 4.47 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.09 38.79 0.36 Allowed 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 120.687 0.28 . . . . 0.0 110.973 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? 69.92 -174.72 0.19 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.666 0.386 . . . . 0.0 110.799 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 93.7 t -103.64 -71.8 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 52.83 -111.18 0.58 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.818 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 12.0 t30 66.63 121.11 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.944 0.402 . . . . 0.0 111.531 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.87 60.37 0.1 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.211 0.529 . . . . 0.0 110.898 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.06 -74.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.998 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.14 -60.65 0.15 Allowed Glycine 0 C--N 1.337 0.605 0 C-N-CA 121.42 -0.419 . . . . 0.0 113.619 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.821 ' O ' HG22 ' B' ' 153' ' ' VAL . 0.0 OUTLIER 65.09 75.17 0.37 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.667 0.387 . . . . 0.0 111.304 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.821 HG22 ' O ' ' B' ' 152' ' ' MET . 1.3 m 61.56 -164.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.782 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.638 ' N ' HG23 ' B' ' 153' ' ' VAL . 0.9 OUTLIER -87.43 154.07 20.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.578 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.793 HG22 ' CE2' ' B' ' 172' ' ' TRP . 3.7 m -141.45 27.01 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' B' ' 171' ' ' ASP . . . -87.16 137.48 32.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.834 0.35 . . . . 0.0 110.57 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 157' ' ' ARG . . . . . 0.455 ' HA ' ' HD3' ' B' ' 157' ' ' ARG . 0.0 OUTLIER -138.76 -165.51 1.84 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.732 0.301 . . . . 0.0 111.798 -179.105 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -62.61 67.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' B' ' 157' ' ' ARG . 9.2 mt -142.86 -54.79 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.611 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -112.26 -178.68 3.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.424 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.25 -80.22 0.58 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 162' ' ' ASN . . . . . 0.449 ' HB3' ' HA ' ' B' ' 171' ' ' ASP . 0.1 OUTLIER 67.9 35.95 3.63 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 179.869 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -155.75 177.9 32.61 Favored Glycine 0 C--N 1.336 0.582 0 CA-C-N 116.446 -0.343 . . . . 0.0 112.366 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.512 ' HB3' ' CD ' ' B' ' 168' ' ' GLU . 10.6 t -137.0 -155.35 0.61 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.247 0.523 . . . . 0.0 112.293 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.54 22.22 15.7 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -178.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.503 ' HB3' HG21 ' B' ' 122' ' ' VAL . . . -128.03 -98.65 0.37 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.171 -0.33 . . . . 0.0 111.56 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -138.01 55.43 1.77 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.128 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.571 ' HB2' ' HG3' ' A' ' 35' ' ' GLU . 1.1 pm0 -140.6 93.49 2.62 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.216 0.531 . . . . 0.0 110.85 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -138.47 125.67 21.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.465 ' CB ' ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -145.35 -46.86 0.22 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.487 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.563 ' HB3' ' HB3' ' B' ' 156' ' ' ALA . 0.6 OUTLIER 64.81 -83.58 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.193 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.793 ' CE2' HG22 ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.746 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.503 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C3'-C2'-C1' 101.848 -0.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.616 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 101.348 -0.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C3'-C2'-C1' 104.643 1.388 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.473 ' C2 ' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.986 0 C1'-O4'-C4' 107.07 -1.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.491 ' N2 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.806 0 C4'-C3'-C2' 104.734 1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.579 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.75 0 C4'-C3'-C2' 104.44 1.24 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.571 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C3'-C2'-C1' 104.916 1.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.725 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 N19-C1'-C2' 115.212 0.632 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.725 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.567 0 C3'-C2'-C1' 104.572 1.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.745 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.899 0 C3'-C2'-C1' 105.384 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.745 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 O4'-C1'-C2' 107.163 0.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.497 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C1'-O4'-C4' 110.636 0.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.403 1.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.402 ' C7 ' ' H41' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O4'-C1'-C2' 107.025 0.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.402 ' H41' ' C7 ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 107.004 0.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.533 ' H8 ' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C4'-C3'-C2' 102.461 -0.739 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.533 ' C8 ' " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 C1'-O4'-C4' 110.434 0.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.524 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.404 -1.265 0 C1'-O4'-C4' 107.553 -1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.513 ' H72' ' CG2' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 C4'-C3'-C2' 104.221 1.021 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.504 ' C6 ' ' C2 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 C3'-C2'-C1' 105.356 1.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.525 ' O4 ' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C4'-C3'-C2' 104.53 1.33 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.548 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-C2' 106.984 0.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.548 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.018 0 C1'-O4'-C4' 106.965 -1.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.18 1.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.404 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 O4'-C1'-C2' 105.014 -0.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C4'-C3' 106.026 0.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 120.359 0.123 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -163.04 175.15 11.4 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.905 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.53 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.2 OUTLIER -123.93 102.12 7.61 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.405 0.622 . . . . 0.0 111.526 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.854 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.9 ttm105 -79.55 111.32 15.7 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.546 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.873 HG21 ' CD2' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -110.26 122.79 65.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.199 179.464 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.725 HG23 ' H73' ' C' ' 178' ' ' ' DT' . 0.5 OUTLIER -131.63 131.93 43.61 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.406 -0.918 . . . . 0.0 112.687 -177.788 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.993 HG22 HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.19 112.17 31.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.053 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.509 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 7.0 p -70.85 81.56 0.64 Allowed 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.923 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.101 HG21 ' CD2' ' A' ' 14' ' ' TYR . 7.0 m -77.39 -137.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.156 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.704 ' HB2' ' HB2' ' B' ' 103' ' ' GLN . 36.9 t70 84.88 -11.47 0.78 Allowed 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -122.13 -63.11 1.32 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.187 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.652 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 0.8 OUTLIER -48.16 -97.94 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.197 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.601 ' O ' ' HB2' ' B' ' 132' ' ' MET . 4.0 m -174.23 41.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.144 -0.972 . . . . 0.0 111.814 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.101 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -80.6 -41.59 23.7 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.0 -46.36 43.78 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -175.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -53.55 -44.82 69.55 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.574 0.625 . . . . 0.0 112.237 -179.351 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.085 HD23 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -63.5 -48.28 78.25 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.444 0.64 . . . . 0.0 111.626 -179.826 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -76.93 -29.97 55.9 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.145 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.44 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.06 -29.71 70.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.764 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.116 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.82 -43.71 11.03 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.61 179.012 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 155.51 37.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.863 ' HB ' HD22 ' A' ' 17' ' ' LEU . 47.6 t -150.82 86.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 121.115 -0.991 . . . . 0.0 113.062 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.976 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -76.59 54.38 0.95 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.164 0.506 . . . . 0.0 111.069 179.081 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.011 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.7 OUTLIER 39.55 -4.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 119.339 3.089 . . . . 0.0 119.339 178.928 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.65 ' HB2' ' P ' ' D' ' 190' ' ' ' DG' . 0.0 OUTLIER -38.69 -63.88 0.48 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 120.267 1.394 . . . . 0.0 110.578 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.511 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.35 -33.38 11.81 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.923 -0.655 . . . . 0.0 111.862 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.682 ' CD1' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -52.61 -61.64 2.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.919 0.39 . . . . 0.0 110.764 178.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.011 HG23 ' CG2' ' A' ' 24' ' ' ILE . 0.9 OUTLIER -53.18 -66.31 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.862 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.655 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 18.5 m -50.97 -41.74 59.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.46 -54.33 11.0 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.776 HG21 HG21 ' B' ' 131' ' ' THR . 17.1 m -54.12 -39.3 66.31 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.78 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.035 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.46 -51.31 58.13 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.178 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.549 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -48.6 -33.37 9.67 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.992 0.814 . . . . 0.0 110.16 179.69 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.3 -57.18 9.07 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.612 ' O ' ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.86 -10.34 59.51 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.603 178.537 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.929 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.49 -28.95 20.49 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.11 -54.0 5.64 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.641 0.734 . . . . 0.0 109.708 179.066 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -33.01 50.22 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.188 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.041 HD23 ' CD2' ' B' ' 120' ' ' TYR . 1.3 mp 42.77 60.95 2.26 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.609 0.763 . . . . 0.0 112.547 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.668 ' HA ' ' NE ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -162.94 70.42 0.26 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.73 178.867 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.15 16.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.36 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 65.6 -67.12 0.14 Allowed 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.11 114.21 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.831 0.348 . . . . 0.0 111.392 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -101.61 133.02 46.95 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.928 0.394 . . . . 0.0 111.166 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -147.03 154.79 41.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.124 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.8 m -106.09 170.4 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.006 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.04 -67.9 0.72 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.793 0.33 . . . . 0.0 111.352 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -106.96 174.43 5.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.927 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -81.61 -79.81 0.16 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.444 ' HA ' ' O ' ' B' ' 144' ' ' TRP . 9.7 mp0 57.94 176.26 0.06 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.171 0.51 . . . . 0.0 112.137 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' A' ' 52' ' ' MET . . . 160.66 -99.98 0.18 Allowed Glycine 0 C--N 1.337 0.611 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.978 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.529 ' SD ' ' HG3' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 83.07 168.74 0.11 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.06 0.544 . . . . 0.0 111.865 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.487 HG12 ' H ' ' A' ' 54' ' ' GLU . 2.1 t -81.71 167.29 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.487 ' H ' HG12 ' A' ' 53' ' ' VAL . 11.4 mm-40 -64.0 -178.6 0.34 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.735 ' O ' HG13 ' A' ' 55' ' ' VAL . 0.8 OUTLIER -169.78 41.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 179.402 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -49.49 -53.33 23.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -66.79 0.28 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.476 0.31 . . . . 0.0 111.724 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.0 t80 178.41 -71.34 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.559 0.218 . . . . 0.0 111.396 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.4 mt -147.48 125.98 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.741 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -129.87 -73.18 0.56 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.094 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 16.9 mtt -136.65 146.03 45.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -71.96 138.93 48.39 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 111.207 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 145.96 84.05 0.06 OUTLIER Glycine 0 C--N 1.334 0.467 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.591 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 86.2 p -79.75 85.92 5.39 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 111.784 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -95.79 -46.7 6.47 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.01 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.27 23.81 11.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.232 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 62.88 178.83 0.14 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.663 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -156.45 121.57 4.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.422 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -104.51 -98.74 0.32 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptt 179.25 133.84 0.09 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.484 0.183 . . . . 0.0 111.158 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.78 120.83 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.241 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.62 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 47.7 p-90 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.317 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.412 ' O ' ' NZ ' ' B' ' 102' ' ' LYS . 11.0 mmm . . . . . 0 N--CA 1.496 1.841 0 CA-C-O 120.989 0.423 . . . . 0.0 111.673 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.509 ' HD3' ' O ' ' A' ' 8' ' ' THR . 4.3 mmtm -149.22 125.85 11.04 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.744 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -94.87 113.58 25.33 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.0 0.428 . . . . 0.0 112.012 -179.473 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.61 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.46 97.81 7.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.942 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.768 HD13 ' CD1' ' A' ' 14' ' ' TYR . 8.9 pt -100.04 113.77 36.51 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.958 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.698 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -117.98 119.32 34.43 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.571 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.19 102.78 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 174.082 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.854 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 14.3 p -67.97 89.8 0.3 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.909 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.97 HG21 ' CB ' ' B' ' 114' ' ' TYR . 5.8 t -80.97 -126.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.455 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.66 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 81.65 -10.65 1.14 Allowed 'General case' 0 C--N 1.351 0.648 0 CA-C-N 118.86 0.755 . . . . 0.0 109.188 -176.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.3 m -128.25 -61.88 1.07 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.001 177.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.655 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.18 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -178.374 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.446 ' HB3' ' O ' ' A' ' 29' ' ' SER . 9.6 t -179.57 41.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.185 0.902 . . . . 0.0 111.428 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.97 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.68 -50.22 8.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.748 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.523 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.61 -41.35 41.97 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.787 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.929 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -51.33 -56.43 13.11 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.539 0.609 . . . . 0.0 110.981 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.684 HD13 ' CE2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER -45.9 -52.68 11.08 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.809 0.814 . . . . 0.0 111.56 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 15.3 pttt -79.43 -30.3 42.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.768 -1.105 . . . . 0.0 111.877 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -66.52 -22.11 66.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.471 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.041 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.13 -41.99 12.65 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.167 178.592 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.656 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.1 t70 170.81 25.43 0.0 OUTLIER 'General case' 0 C--N 1.359 0.999 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.58 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.4 OUTLIER -170.29 107.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.064 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.86 ' O ' HD12 ' B' ' 124' ' ' ILE . 71.6 m-80 -66.8 50.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.732 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.035 HG21 ' CE ' ' A' ' 32' ' ' MET . 1.9 pp 34.89 2.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 119.409 3.115 . . . . 0.0 119.409 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.44 -62.04 0.63 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.294 0.497 . . . . 0.0 110.689 -178.209 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -77.62 -24.7 64.51 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.645 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.653 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.8 tm? -67.67 -57.11 6.96 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.999 0.4 . . . . 0.0 110.774 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.977 HG23 ' HB ' ' B' ' 124' ' ' ILE . 88.3 t -50.19 -73.17 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.895 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.795 ' HA ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.43 -33.89 15.2 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 19.8 m -68.81 -47.36 66.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.776 HG21 HG21 ' A' ' 31' ' ' THR . 89.5 m -59.06 -39.61 82.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.516 177.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.028 ' HA ' HD12 ' A' ' 17' ' ' LEU . 14.7 mmm -57.54 -57.38 12.93 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -59.34 -38.11 79.54 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.074 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -68.15 -46.74 69.96 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.879 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -71.2 -28.82 64.5 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.601 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.823 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.96 -25.67 43.51 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.304 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.41 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 6.4 mtt-85 -82.54 -53.45 5.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.812 0.815 . . . . 0.0 110.487 178.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -17.49 62.37 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.054 -1.43 . . . . 0.0 114.164 -177.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.116 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -33.0 -46.02 0.14 Allowed 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.544 ' H ' HD12 ' B' ' 139' ' ' LEU . 0.3 OUTLIER -178.24 146.8 0.4 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.341 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 66.86 171.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -161.79 112.56 1.65 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.792 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.529 ' HG3' ' SD ' ' A' ' 52' ' ' MET . 0.0 OUTLIER -151.8 179.81 8.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.377 -179.476 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.444 ' O ' ' HA ' ' A' ' 50' ' ' GLU . 1.0 OUTLIER 80.76 50.66 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.769 0.428 . . . . 0.0 112.02 179.656 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.43 ' HE3' ' O ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -56.5 -46.54 80.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.832 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.4 p -87.92 124.74 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-O 120.888 0.375 . . . . 0.0 111.524 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.83 169.96 13.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.07 177.15 8.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 66.01 81.84 0.2 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.782 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.89 164.15 39.27 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.122 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.25 -64.58 0.57 Allowed Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.206 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.8 79.6 2.73 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.032 0.444 . . . . 0.0 111.45 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.9 m -113.73 142.92 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.996 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.59 ' O ' HG23 ' B' ' 155' ' ' VAL . 0.0 OUTLIER -137.42 -176.88 4.55 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.842 179.51 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.733 ' HA ' ' HB2' ' B' ' 172' ' ' TRP . 24.9 t -159.53 101.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 121.504 0.668 . . . . 0.0 111.104 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.405 ' H ' ' HD1' ' B' ' 172' ' ' TRP . . . -163.43 127.55 2.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.982 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.87 76.06 1.63 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.134 0.493 . . . . 0.0 111.614 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.8 t80 68.56 -60.37 0.43 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.479 HG23 ' H ' ' B' ' 160' ' ' GLU . 4.9 tp -138.46 -56.24 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.479 ' H ' HG23 ' B' ' 159' ' ' ILE . 0.0 OUTLIER -166.25 172.13 11.47 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.756 0.312 . . . . 0.0 111.224 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 54.2 mtm -100.57 155.1 18.05 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -88.5 -44.49 10.66 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.365 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' B' ' 164' ' ' SER . . . 143.28 156.14 6.68 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.714 -0.755 . . . . 0.0 113.097 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.425 ' HB3' ' O ' ' B' ' 163' ' ' GLY . 22.0 t 76.77 141.81 0.07 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.797 0.439 . . . . 0.0 111.665 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' B' ' 168' ' ' GLU . 0.1 OUTLIER -166.54 117.12 0.95 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.36 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.6 ' HB3' ' CB ' ' B' ' 121' ' ' ASP . . . -95.99 -39.29 9.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.206 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.449 ' HB2' ' CE1' ' B' ' 120' ' ' TYR . 2.5 t0 -144.22 60.18 1.35 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.383 0.611 . . . . 0.0 111.447 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.637 ' HB3' ' CE1' ' B' ' 165' ' ' PHE . 5.8 tt0 -175.98 174.02 2.17 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.387 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.72 -73.36 0.06 Allowed 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.422 ' NZ ' ' O ' ' B' ' 155' ' ' VAL . 0.4 OUTLIER -139.79 141.45 36.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.871 0.367 . . . . 0.0 111.362 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.44 ' CA ' HG13 ' B' ' 155' ' ' VAL . 0.2 OUTLIER -157.95 168.58 26.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.984 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.733 ' HB2' ' HA ' ' B' ' 155' ' ' VAL . 2.0 t90 . . . . . 0 C--O 1.252 1.228 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.72 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 101.966 -0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.663 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 100.996 -1.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.663 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C1'-C2' 107.284 1.076 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.459 ' H71' ' HG3' ' B' ' 102' ' ' LYS . . . . . . . . 0 O4'--C1' 1.407 -0.997 0 C1'-O4'-C4' 106.96 -1.957 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.639 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.772 0 C4'-C3'-C2' 104.8 1.6 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.725 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.411 -0.723 0 C4'-C3'-C2' 104.687 1.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.629 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C1'-C2' 107.084 0.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.629 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.715 0 C4'-C3'-C2' 104.305 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 107.017 0.833 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.625 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.9 0 C1'-O4'-C4' 107.405 -1.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.625 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 O4'-C1'-C2' 106.868 0.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.464 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 N19-C1'-C2' 115.141 0.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.048 0.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C4'-C3' 104.74 -0.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C4'-C3'-C2' 102.601 -0.599 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.415 " O5'" ' HD3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 O4'-C1'-C2' 107.263 1.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.559 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.868 0 C4'-C3'-C2' 104.639 1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.65 ' P ' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.036 0 C3'-C2'-C1' 104.837 1.526 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.592 ' H72' ' CG2' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 105.398 1.927 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.542 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.737 0 C4'-C3'-C2' 105.001 1.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.548 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.754 0 C3'-C2'-C1' 105.363 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.548 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.542 0 C3'-C2'-C1' 104.779 1.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.491 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 C3'-C2'-C1' 105.185 1.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 " O5'" H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 O4'-C1'-C2' 106.859 0.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.491 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 N19-C1'-C2' 115.616 0.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.467 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C1'-O4'-C4' 110.339 0.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 110.911 -0.033 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.0 ptpt -37.28 128.29 1.0 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.858 0.361 . . . . 0.0 111.617 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.622 ' O ' ' HA ' ' B' ' 108' ' ' THR . 34.5 tp60 -95.9 118.51 32.67 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.211 0.529 . . . . 0.0 110.997 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.969 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.84 105.82 9.28 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.698 0.761 . . . . 0.0 111.584 -178.553 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.72 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -108.99 111.51 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 177.809 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.66 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -116.49 128.38 55.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.517 -177.424 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.94 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -98.87 101.51 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 176.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.436 ' CG2' ' NH1' ' B' ' 104' ' ' ARG . 2.3 p -69.72 67.81 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.8 0.81 . . . . 0.0 109.272 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.982 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.4 p -79.9 -135.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.384 -178.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.785 ' H ' HG22 ' A' ' 9' ' ' VAL . 5.8 t70 91.2 -0.33 0.17 Allowed 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 119.591 1.087 . . . . 0.0 109.165 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.5 -55.98 0.69 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.673 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 0.6 OUTLIER -45.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 123.526 0.516 . . . . 0.0 111.579 -179.487 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.561 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 0.3 OUTLIER 176.59 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 119.176 0.898 . . . . 0.0 111.771 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.39 -43.15 16.21 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.8 mp0 -49.83 -39.99 40.68 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -176.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.816 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -57.28 -56.6 19.75 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.829 HD13 HD11 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -54.15 -47.35 72.05 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.021 -0.672 . . . . 0.0 112.268 -177.36 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.719 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 pttt -73.24 -25.76 60.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.301 0.572 . . . . 0.0 110.01 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.1 -28.61 69.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.052 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.802 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.32 -43.12 11.77 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.305 178.685 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.6 t70 163.84 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.725 ' HB ' HD23 ' A' ' 17' ' ' LEU . 47.6 t -137.89 89.06 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 119.624 1.102 . . . . 0.0 113.588 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.6 m-80 -68.93 61.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.946 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 45.41 -16.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 117.871 2.545 . . . . 0.0 117.871 -179.362 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.573 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 7.8 t -37.61 -64.49 0.38 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.758 1.163 . . . . 0.0 112.013 -176.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.91 -22.45 57.72 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.829 HD11 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.81 -62.05 1.72 Allowed 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 122.728 0.411 . . . . 0.0 110.767 179.644 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.97 HG23 ' CG2' ' A' ' 24' ' ' ILE . 5.2 t -48.79 -63.01 0.4 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.98 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.684 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.825 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -48.44 -36.45 14.94 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.595 HG23 ' CE ' ' A' ' 61' ' ' MET . 25.4 m -69.91 -52.66 22.76 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.615 HG21 ' HB ' ' B' ' 131' ' ' THR . 20.6 m -61.23 -39.24 89.55 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.86 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.885 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.7 mmt -60.06 -57.88 10.94 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.893 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.448 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 3.0 tt0 -57.16 -35.22 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -50.41 33.13 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.848 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.5 tp10 -72.96 -16.34 61.53 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.685 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -86.01 -47.95 9.12 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.815 0.446 . . . . 0.0 110.117 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 1.2 mmt180 -55.58 -52.03 65.12 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.57 0.7 . . . . 0.0 110.77 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -72.85 -50.46 23.82 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.957 -178.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.658 HD11 ' CD2' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 26.21 55.25 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.4 80.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 128.34 0.24 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.954 0.407 . . . . 0.0 112.084 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.53 157.47 18.07 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.112 0.482 . . . . 0.0 111.293 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -150.16 -61.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.261 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER 67.12 -59.6 0.38 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.337 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -104.09 115.2 29.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.189 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' A' ' 48' ' ' ASN . 2.7 t -114.93 32.54 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.619 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 53.31 -74.99 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' A' ' 46' ' ' VAL . 63.9 t30 60.37 29.17 18.79 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.627 0.251 . . . . 0.0 111.327 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -149.87 164.13 36.19 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.773 0.32 . . . . 0.0 111.403 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 56.0 -114.98 0.88 Allowed 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.333 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.8 164.87 11.31 Favored Glycine 0 C--N 1.339 0.713 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.351 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.627 ' HB2' ' HB3' ' B' ' 144' ' ' TRP . 0.3 OUTLIER -130.49 157.29 43.07 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.872 0.367 . . . . 0.0 111.559 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.477 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 91.3 t -80.51 -59.19 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.231 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.543 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.5 pm0 -72.31 148.64 45.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.683 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.695 ' CB ' ' HB2' ' B' ' 143' ' ' ARG . 15.9 m -130.05 21.74 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.49 ' HB2' ' CD1' ' A' ' 72' ' ' TRP . . . -74.38 64.02 1.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.06 0.457 . . . . 0.0 111.713 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -125.7 22.34 7.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.28 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.605 ' HB3' ' NH2' ' B' ' 143' ' ' ARG . 14.7 p90 -162.62 147.46 12.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.556 0.217 . . . . 0.0 111.447 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 pt -154.61 47.46 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.762 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -153.12 63.03 0.77 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.595 ' CE ' HG23 ' A' ' 30' ' ' THR . 0.1 OUTLIER -179.52 140.93 0.15 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.598 179.099 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -141.27 59.54 1.51 Allowed 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.823 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -157.17 -123.94 0.78 Allowed Glycine 0 C--N 1.334 0.421 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.436 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 65.92 -62.6 0.24 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.83 0.452 . . . . 0.0 111.19 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 44.19 75.84 0.09 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.27 -62.21 1.6 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.129 0.49 . . . . 0.0 111.661 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -171.3 -71.15 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.095 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -89.52 120.23 30.65 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.766 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.91 111.75 5.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.527 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -152.95 110.02 3.49 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.592 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.401 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.6 OUTLIER -118.69 -174.15 2.63 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.924 179.657 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.543 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 6.2 t-105 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.623 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 1.8 ttp . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.4 102.9 8.77 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 36.4 tt0 -101.97 114.6 28.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.243 0.544 . . . . 0.0 109.975 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.51 ' HD2' ' N7 ' ' D' ' 192' ' ' ' DA' . 11.9 ttm-85 -79.32 99.93 7.34 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.282 -177.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.65 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -108.1 110.31 31.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.72 ' O ' " H2'" ' D' ' 190' ' ' ' DG' . 0.3 OUTLIER -107.15 122.19 46.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.863 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.72 HG13 HG12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.08 95.11 3.76 Favored 'Isoleucine or valine' 0 C--N 1.343 0.285 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.969 HG22 ' HG3' ' A' ' 4' ' ' ARG . 74.3 p -68.16 94.03 0.48 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.248 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.088 HG21 ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -80.9 -132.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.925 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.497 ' H ' HG12 ' B' ' 109' ' ' VAL . 19.9 t70 91.23 -12.53 0.24 Allowed 'General case' 0 C--N 1.351 0.637 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -129.66 -54.27 1.15 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.445 178.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.825 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.7 OUTLIER -48.72 -99.63 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -179.2 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.229 -0.92 . . . . 0.0 110.828 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.088 ' HB3' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.27 -39.14 21.23 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.944 1.091 . . . . 0.0 113.944 -179.062 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.3 -39.63 22.43 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -175.183 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.685 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -60.89 -56.68 18.27 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 1.105 HD22 HG11 ' B' ' 122' ' ' VAL . 1.5 mt -57.46 -38.19 74.09 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.318 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.63 ' HD3' ' OH ' ' B' ' 114' ' ' TYR . 0.8 OUTLIER -79.35 -31.23 42.96 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.155 0.503 . . . . 0.0 111.132 178.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.585 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.67 -28.92 67.69 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.364 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.072 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.28 -42.62 12.13 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 117.469 -1.253 . . . . 0.0 110.977 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.708 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 2.7 p30 151.35 12.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 1.105 HG11 HD22 ' B' ' 117' ' ' LEU . 1.4 p -89.83 -31.17 5.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 118.882 0.764 . . . . 0.0 112.886 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.008 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m-80 36.04 41.12 0.12 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.028 0.531 . . . . 0.0 111.621 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.008 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.5 OUTLIER 43.74 -8.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 N-CA-C 118.494 2.775 . . . . 0.0 118.494 179.438 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.94 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.87 -63.29 0.54 Allowed 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.114 1.324 . . . . 0.0 110.026 -177.842 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.43 -23.19 54.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.024 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.686 ' CD1' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.72 -61.05 2.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.521 0.328 . . . . 0.0 111.209 179.892 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.844 HG23 ' CG2' ' B' ' 124' ' ' ILE . 17.2 t -50.13 -63.69 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.459 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 13.5 p -49.9 -43.83 49.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 23.5 m -68.87 -53.68 19.88 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.633 HG22 ' O ' ' B' ' 128' ' ' VAL . 2.1 t -56.14 -40.23 73.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.688 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.814 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -62.09 -57.75 10.4 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.282 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.561 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 1.3 tp60 -49.65 -40.9 41.22 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.038 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.603 ' HB3' ' HG2' ' B' ' 142' ' ' GLU . 81.4 m-20 -69.56 -57.12 5.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.072 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.719 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -66.81 -14.73 62.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.333 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.14 -52.79 5.05 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.198 0.599 . . . . 0.0 111.689 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -54.96 -56.32 20.93 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.379 0.609 . . . . 0.0 111.825 -178.711 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.57 ' HB2' ' HB2' ' B' ' 142' ' ' GLU . 0.1 OUTLIER -83.15 -24.78 32.38 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.095 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.802 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 40.44 47.22 2.21 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-O 121.506 0.67 . . . . 0.0 111.116 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -168.14 -58.73 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.044 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.48 -44.39 0.22 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.603 ' HG2' ' HB3' ' B' ' 134' ' ' ASN . 3.8 tp10 54.12 82.36 0.09 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.695 ' HB2' ' CB ' ' A' ' 55' ' ' VAL . 23.8 mmt180 -149.59 122.93 9.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.785 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.627 ' HB3' ' HB2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -129.11 -162.21 1.18 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.712 0.291 . . . . 0.0 110.997 -179.181 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.503 ' O ' HG23 ' B' ' 146' ' ' VAL . 1.2 ttpt -67.71 -45.25 75.64 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER 52.4 66.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 121.344 0.592 . . . . 0.0 110.931 -179.508 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -87.9 171.33 10.43 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.44 116.07 25.3 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.534 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.64 155.12 4.74 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.136 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -135.63 157.68 46.28 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.124 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -104.99 -177.2 24.53 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.856 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.3 tpp -139.73 51.42 1.73 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.86 0.362 . . . . 0.0 111.509 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.8 p -179.14 123.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.4 ' O ' HG13 ' B' ' 155' ' ' VAL . 1.1 pm0 -115.05 148.08 39.34 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 111.845 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.4 HG13 ' O ' ' B' ' 154' ' ' GLU . 1.5 m -155.69 61.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.697 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -106.13 -43.67 4.77 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -152.44 173.35 15.22 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.495 0.188 . . . . 0.0 111.379 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -54.37 -39.63 67.35 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.781 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.7 mp -105.64 115.47 47.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-O 120.888 0.375 . . . . 0.0 110.873 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -66.67 156.63 34.71 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.398 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 4.3 ttt 68.65 88.21 0.11 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.643 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -54.99 -34.77 63.69 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.687 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 126.74 -70.95 0.49 Allowed Glycine 0 C--N 1.337 0.621 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.422 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t 79.05 -174.7 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.225 0.536 . . . . 0.0 111.972 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.75 -153.06 0.3 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.081 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.575 ' HB3' ' CG ' ' B' ' 121' ' ' ASP . . . -52.44 -74.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.043 0.449 . . . . 0.0 110.677 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.11 63.91 0.61 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.866 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.69 165.69 17.47 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.172 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -144.22 150.66 38.32 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.973 0.416 . . . . 0.0 111.752 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' B' ' 170' ' ' LYS . 0.0 OUTLIER -128.41 121.28 28.68 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.842 179.402 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -60.58 145.41 48.9 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.275 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 80.2 m95 . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.938 -179.708 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.486 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-C2' 106.848 0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.486 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C1'-O4'-C4' 110.295 0.425 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.468 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 104.641 1.386 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.405 " O4'" " H1'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.949 0 C4'-C3'-C2' 104.627 1.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.495 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C4'-C3'-C2' 104.704 1.504 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.506 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.664 0 C4'-C3'-C2' 104.555 1.355 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.596 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 104.899 1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.716 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 N19-C1'-C2' 115.72 0.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.716 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 O4'-C1'-C2' 107.229 1.026 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.62 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.771 0 C3'-C2'-C1' 105.61 2.079 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.62 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 N19-C1'-C2' 112.548 -1.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.472 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.597 -0.788 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 106.981 0.801 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 C1'-O4'-C4' 110.506 0.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 O4'-C1'-C2' 107.126 0.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.502 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 101.571 -0.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.797 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C4'-C3'-C2' 101.833 -1.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.797 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.857 0 C4'-C3'-C2' 104.32 1.12 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.699 ' H72' ' C5 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.977 0 C3'-C2'-C1' 101.416 -0.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.531 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 C3'-C2'-C1' 105.417 1.941 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.531 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.699 0 C4'-C3'-C2' 104.575 1.375 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.41 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C1'-O4'-C4' 110.597 0.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.444 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.979 0 C1'-O4'-C4' 106.841 -2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.463 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.526 0 C1'-O4'-C4' 110.909 0.864 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.426 ' C5 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 O4'-C1'-C2' 104.864 -1.124 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C1'-O4'-C4' 110.435 0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.484 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 66.2 mtm . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 1' ' ' MET . 2.0 mptp? 72.49 109.58 0.07 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.991 0.424 . . . . 0.0 110.451 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 108' ' ' THR . 29.3 tp60 -104.2 107.38 18.26 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.219 0.533 . . . . 0.0 110.235 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 5.6 ttm180 -78.19 102.87 7.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.72 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.0 ' CD1' HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -108.1 127.19 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 177.416 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.798 HG23 ' H73' ' C' ' 178' ' ' ' DT' . 0.2 OUTLIER -129.73 127.77 41.11 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.81 -0.756 . . . . 0.0 112.529 -176.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.709 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.57 109.06 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.363 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' B' ' 102' ' ' LYS . 5.8 p -70.56 94.31 0.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.083 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.026 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.8 t -84.6 -132.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.827 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.675 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 3.8 t70 82.63 -10.32 1.07 Allowed 'General case' 0 C--N 1.35 0.627 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.1 m -128.4 -58.18 1.19 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.204 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 1.3 m-20 -49.7 -101.96 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -177.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 36.02 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.558 -0.714 . . . . 0.0 110.701 -178.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.026 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.01 -39.15 23.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.303 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.12 -45.52 33.12 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -176.846 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.807 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -54.59 -47.32 73.49 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.943 0.792 . . . . 0.0 111.893 -179.615 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.848 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.82 -49.86 76.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.117 -179.461 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.5 OUTLIER -73.99 -26.06 60.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.299 178.581 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -65.38 -27.53 68.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.409 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.732 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.1 -42.19 12.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.468 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.6 21.34 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 176.287 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.6 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 61.7 t -156.71 94.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.597 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' ' HE1' ' B' ' 132' ' ' MET . 3.3 p30 -60.34 -93.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.079 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -148.61 3.08 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 179.072 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.626 ' HB2' ' OP1' ' D' ' 190' ' ' ' DG' . 4.1 t -38.03 -63.17 0.5 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.662 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.05 -29.99 18.63 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.507 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.728 ' HB3' HG22 ' A' ' 24' ' ' ILE . 13.0 tp -56.52 -61.97 2.05 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 117.282 0.541 . . . . 0.0 110.718 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.079 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.1 t -54.66 -57.09 7.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-O 121.774 0.797 . . . . 0.0 109.097 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.85 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 60.2 m -47.38 -49.84 23.71 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.802 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.5 OUTLIER -80.75 -47.4 13.99 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.78 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.34 -43.83 92.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.69 -179.321 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.049 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.6 mmt -54.01 -57.11 12.26 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.319 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -54.86 -36.97 65.66 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -52.88 22.03 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.919 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.6 tp10 -70.78 -25.31 62.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.408 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.748 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -81.88 -25.22 35.21 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 122.839 0.456 . . . . 0.0 110.747 178.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -79.66 -46.99 16.14 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 122.095 0.95 . . . . 0.0 108.835 178.05 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.524 ' C ' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -76.89 -46.36 24.73 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 113.233 -1.803 . . . . 0.0 113.172 -177.712 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.012 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 8.59 65.07 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.514 0.726 . . . . 0.0 112.935 -177.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 175.88 62.87 0.0 OUTLIER 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.322 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 179.23 159.79 0.68 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.613 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -69.37 51.34 0.1 Allowed 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 73.28 134.75 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.3 67.48 1.9 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.046 0.451 . . . . 0.0 109.991 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.418 ' NZ ' ' O ' ' B' ' 150' ' ' GLU . 3.7 pttt -87.02 151.82 22.93 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 30.5 m -121.09 122.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.139 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.15 -160.47 1.01 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.876 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 82.94 120.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.235 0.54 . . . . 0.0 111.742 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pm0 -171.52 125.48 0.61 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.296 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.89 -75.15 0.52 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -178.64 73.79 0.07 OUTLIER Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.938 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.32 163.72 32.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.701 0.286 . . . . 0.0 110.62 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 85.2 t -99.31 -65.09 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.228 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -86.6 149.94 24.57 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.901 0.381 . . . . 0.0 111.486 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.623 ' O ' HG12 ' A' ' 55' ' ' VAL . 67.9 t -124.38 4.24 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.97 136.58 56.15 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.97 0.414 . . . . 0.0 111.611 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.2 mtt-85 -148.33 -65.67 0.24 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.409 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.463 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -154.5 -155.34 0.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.787 -179.627 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.463 ' HB ' ' O ' ' A' ' 58' ' ' PHE . 2.7 mp 77.38 100.98 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.941 0.4 . . . . 0.0 111.132 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.16 -42.71 83.86 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.347 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.4 mmt -61.58 121.77 13.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -45.19 130.18 7.9 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.77 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -72.14 92.74 0.57 Allowed Glycine 0 C--N 1.331 0.299 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.918 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.7 t 67.54 -150.92 0.18 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.489 0.185 . . . . 0.0 111.208 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.3 87.43 1.81 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.823 0.344 . . . . 0.0 111.692 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.408 ' HA ' HG21 ' A' ' 22' ' ' VAL . . . -139.76 -126.25 0.11 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.721 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -126.52 71.47 1.29 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 111.246 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -94.98 48.67 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.653 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -65.05 -74.58 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.8 58.47 0.14 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 62.32 -70.76 0.05 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.597 ' CE3' ' HD2' ' B' ' 140' ' ' ARG . 1.1 t90 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.95 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 N-CA-C 111.348 0.129 . . . . 0.0 111.348 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 22.7 mmmt -104.05 -176.59 3.12 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.046 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.648 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -104.88 107.68 18.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.119 0.485 . . . . 0.0 111.014 179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.599 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.2 OUTLIER -78.59 106.97 10.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.856 0.836 . . . . 0.0 111.875 -178.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.754 HD11 HG11 ' B' ' 128' ' ' VAL . 1.4 pt -110.04 120.77 61.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.089 178.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.676 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.01 125.8 32.38 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -177.993 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 1.0 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.47 103.84 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.829 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 82.1 p -68.94 90.15 0.43 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.192 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.1 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.2 t -79.22 -134.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.296 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 35.3 t70 90.54 -5.74 0.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.711 0.767 . . . . 0.0 109.192 -176.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -134.61 -59.37 0.81 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.156 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.85 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 1.5 m-20 -47.98 -95.03 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.578 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 1.2 m -177.93 35.0 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.362 -0.836 . . . . 0.0 111.404 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.1 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -80.6 -43.97 19.7 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.645 0.778 . . . . 0.0 111.269 179.302 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.702 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 81.8 mt-30 -49.81 -38.29 34.01 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.68 -177.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.748 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -57.27 -56.52 20.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.528 0.603 . . . . 0.0 112.211 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 1.049 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -54.6 -40.07 68.51 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.733 -178.29 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.24 -32.3 43.79 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.458 0.647 . . . . 0.0 110.938 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.556 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -62.98 -28.88 70.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.611 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.012 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -88.02 -46.28 9.47 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.661 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 3.2 t0 165.87 12.72 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.447 ' O ' HD22 ' B' ' 117' ' ' LEU . 72.7 t -153.69 91.99 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-N 118.783 0.719 . . . . 0.0 112.014 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.0 OUTLIER -59.3 -102.36 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.012 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.37 4.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 179.15 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.439 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -44.41 -64.03 0.77 Allowed 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.327 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.463 ' HA2' ' OG ' ' B' ' 129' ' ' SER . . . -86.1 -29.74 24.72 Favored Glycine 0 C--N 1.337 0.631 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.071 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.682 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.4 -61.38 2.37 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 122.342 0.257 . . . . 0.0 110.649 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.999 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -54.64 -61.88 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-O 121.347 0.594 . . . . 0.0 110.103 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.874 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 9.0 p -47.99 -44.05 30.32 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -78.65 -47.79 16.34 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.447 0.567 . . . . 0.0 109.972 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.433 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 3.2 m -60.13 -47.69 84.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.322 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.848 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 4.5 mmt -54.64 -53.63 52.28 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.484 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -49.39 -40.11 34.86 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -69.75 -48.99 57.37 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 121.367 -0.133 . . . . 0.0 110.911 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -74.66 -13.57 60.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.914 0.388 . . . . 0.0 110.214 178.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.807 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.75 -48.52 7.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -51.6 -54.53 26.69 Favored 'General case' 0 CA--C 1.5 -0.97 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.266 178.701 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -82.01 -50.1 9.5 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.505 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 47.24 76.07 0.11 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 179.12 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.597 ' HD2' ' CE3' ' A' ' 72' ' ' TRP . 0.2 OUTLIER 168.36 159.34 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 178.382 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -82.77 126.58 32.57 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.844 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' B' ' 143' ' ' ARG . 18.5 tt0 -163.45 160.08 22.94 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.683 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.462 ' C ' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 8.66 89.6 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 179.535 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.445 ' C ' ' HG3' ' B' ' 145' ' ' LYS . 9.7 p-90 -74.7 39.36 0.13 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.445 ' HG3' ' C ' ' B' ' 144' ' ' TRP . 0.0 OUTLIER 163.1 152.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.687 0.795 . . . . 0.0 110.081 179.355 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 33.2 m -101.74 162.13 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -140.15 34.21 1.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.051 0.453 . . . . 0.0 111.378 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -137.03 -166.35 1.9 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.664 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -76.46 -87.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.534 0.207 . . . . 0.0 111.51 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 150' ' ' GLU . . . . . 0.418 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 4.0 tp10 -163.4 -56.9 0.04 OUTLIER 'General case' 0 C--O 1.239 0.527 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.241 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 138.81 -162.39 25.88 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.742 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -147.18 68.06 1.15 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.184 0.516 . . . . 0.0 111.135 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.479 HG22 ' H ' ' B' ' 154' ' ' GLU . 2.2 p -171.58 170.09 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.001 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.479 ' H ' HG22 ' B' ' 153' ' ' VAL . 0.0 OUTLIER -127.97 149.55 50.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.923 0.392 . . . . 0.0 110.807 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.474 ' CG2' ' CZ2' ' B' ' 172' ' ' TRP . 3.3 m -147.65 40.82 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 121.37 0.605 . . . . 0.0 111.326 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.4 -159.13 0.18 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.078 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.94 156.39 22.33 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.779 0.323 . . . . 0.0 111.092 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.448 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 44.8 m-85 -91.68 -160.4 0.73 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.992 179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 44.1 mt 74.33 -64.94 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.98 77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.295 0.569 . . . . 0.0 111.875 -179.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.6 ptm -161.37 76.49 0.53 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.901 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -135.01 -66.66 0.57 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.363 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -77.74 -0.14 73.23 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.692 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 5.3 t 79.3 179.57 0.11 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.911 0.355 . . . . 0.0 111.213 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.654 ' CG ' ' HB3' ' B' ' 168' ' ' GLU . 0.3 OUTLIER -172.24 114.73 0.32 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.404 -179.567 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -67.66 -28.41 67.68 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -95.83 -52.53 4.04 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.654 ' HB3' ' CG ' ' B' ' 165' ' ' PHE . 12.1 tp10 -48.63 104.38 0.06 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.094 0.473 . . . . 0.0 111.308 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -71.32 -22.92 61.86 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? 70.22 -59.36 0.52 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.544 0.211 . . . . 0.0 111.394 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.44 ' O ' ' CB ' ' B' ' 172' ' ' TRP . 1.1 m-20 -64.47 -18.2 64.55 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.607 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.474 ' CZ2' ' CG2' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.256 0 C-N-CA 123.608 0.763 . . . . 0.0 109.998 -179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.488 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C3'-C2'-C1' 101.764 -0.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.553 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 N19-C1'-C2' 115.266 0.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.553 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 O4'-C1'-C2' 107.381 1.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.417 ' C7 ' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.925 0 C4'-C3'-C2' 104.634 1.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.689 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.022 0 C3'-C2'-C1' 104.87 1.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.798 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 C2'--C1' 1.511 -0.699 0 O4'-C1'-C2' 104.923 -1.07 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.919 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 106.198 2.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.919 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 N19-C1'-C2' 114.948 0.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.666 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 104.489 1.278 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.653 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.765 0 C3'-C2'-C1' 105.548 2.034 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.653 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-C2' 106.917 0.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.582 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.146 0.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . 0.44 ' C2 ' ' C6 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C5'-C4'-O4' 108.767 -0.396 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 C3'-C2'-C1' 101.946 -0.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.633 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.549 0 O4'-C1'-C2' 106.866 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.633 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.538 0 C4'-C3'-C2' 103.977 0.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.442 H2'' ' OP2' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C4'-C3'-C2' 102.34 -0.86 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.626 ' OP1' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C3'-C2'-C1' 105.896 2.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.545 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C4'-C3' 104.492 -1.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.527 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.788 0 C1'-O4'-C4' 110.807 0.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.599 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.41 -0.794 0 C3'-C2'-C1' 104.971 1.622 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.475 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 O4'-C1'-C2' 107.127 0.934 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.475 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.939 0 C1'-O4'-C4' 107.581 -1.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.292 1.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.536 0.798 0 O4'-C1'-C2' 105.151 -0.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C1'-O4'-C4' 110.26 0.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 ttp . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 -174.04 4.77 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.581 0.229 . . . . 0.0 110.982 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.661 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 4.2 tt0 -124.23 121.8 36.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.584 0.707 . . . . 0.0 111.771 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.889 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.7 ttp-105 -79.81 113.25 17.82 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.069 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.813 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -103.4 124.35 57.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.65 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.645 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -129.99 123.61 31.01 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.434 -0.906 . . . . 0.0 111.844 -177.723 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.877 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.67 108.46 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.9 p -70.9 89.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.04 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.1 t -86.41 -132.31 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 119.106 -0.473 . . . . 0.0 111.985 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.9 t70 82.4 -8.82 1.21 Allowed 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -175.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -130.1 -63.23 0.91 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.119 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.713 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.72 -89.84 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.772 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.9 t 176.53 39.55 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.705 0.764 . . . . 0.0 110.772 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.04 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.71 -44.25 14.67 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.877 -179.251 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.623 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -47.53 -37.9 13.04 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -175.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.81 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.83 -56.6 19.27 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.721 0.692 . . . . 0.0 112.458 -179.628 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.919 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.65 -43.87 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.457 0.646 . . . . 0.0 111.378 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.738 ' HB3' ' HB3' ' A' ' 23' ' ' ASN . 4.2 pttt -79.65 -30.95 41.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.605 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.34 -29.05 67.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.873 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.926 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.12 -46.55 9.2 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.463 178.459 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 154.83 19.72 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 176.125 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.657 ' O ' HD12 ' A' ' 17' ' ' LEU . 75.0 t -156.58 84.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 118.165 0.438 . . . . 0.0 111.678 -178.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.738 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -58.08 -96.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.067 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -138.98 -3.71 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 115.664 1.728 . . . . 0.0 115.664 -179.427 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.55 ' HB3' ' OP2' ' D' ' 190' ' ' ' DG' . 78.3 p -39.05 -64.23 0.47 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-N 119.057 0.844 . . . . 0.0 109.501 -179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.468 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -85.22 -29.99 26.46 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.65 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 4.9 tp -58.64 -61.98 2.2 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.875 0.338 . . . . 0.0 110.83 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.067 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.03 -67.25 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.65 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 90.9 p -48.45 -36.76 15.64 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -78.47 -45.93 20.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.556 0.616 . . . . 0.0 109.595 178.427 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.544 ' OG1' HG21 ' B' ' 131' ' ' THR . 20.9 m -64.0 -50.02 70.18 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.65 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.72 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 2.6 mmt -50.96 -43.13 60.33 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.849 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.448 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -61.21 -48.92 79.27 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.039 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -47.47 85.4 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.861 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -64.75 -38.63 91.64 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.57 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.598 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.11 -47.27 85.87 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -51.91 67.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 39' ' ' LEU . 6.2 mmt180 -52.97 -49.93 65.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.925 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.92 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER -16.86 108.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.328 1.051 . . . . 0.0 113.2 179.681 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -141.35 -55.93 0.48 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.88 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.47 153.5 17.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.36 178.79 6.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.922 0.392 . . . . 0.0 111.808 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.688 ' NH1' ' HA ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -164.74 -80.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.405 178.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.483 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 161.03 -59.86 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.392 0.677 . . . . 0.0 110.362 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.535 ' CE ' HG12 ' A' ' 46' ' ' VAL . 0.0 OUTLIER 72.14 119.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.596 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.535 HG12 ' CE ' ' A' ' 45' ' ' LYS . 14.6 p -51.87 129.02 11.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 111.542 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -78.93 115.49 18.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.541 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -169.94 145.18 2.88 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.968 0.413 . . . . 0.0 111.506 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.56 103.7 12.87 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.197 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.63 155.14 25.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.907 0.384 . . . . 0.0 111.625 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 174.16 126.9 0.95 Allowed Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.488 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.8 mtt -106.06 145.99 30.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.793 0.33 . . . . 0.0 111.304 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.451 HG12 ' N ' ' A' ' 54' ' ' GLU . 21.9 t -83.4 158.24 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.608 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.632 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.7 pt-20 36.94 55.18 1.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.444 0.64 . . . . 0.0 112.478 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.518 HG22 ' CB ' ' A' ' 72' ' ' TRP . 8.0 m -89.29 74.93 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.177 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.425 ' O ' ' N ' ' A' ' 58' ' ' PHE . . . -110.5 -85.28 0.55 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.959 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 56.87 -79.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.711 0.405 . . . . 0.0 111.818 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -143.92 75.4 1.47 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.108 0.48 . . . . 0.0 110.32 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.7 tt -112.12 84.12 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.251 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.5 143.94 44.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.232 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.456 ' HG3' ' HD2' ' B' ' 140' ' ' ARG . 5.9 mmt -159.11 75.78 0.69 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -67.99 64.64 0.09 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.342 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 162.53 95.75 0.11 Allowed Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.94 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.4 p -84.48 158.94 20.85 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.836 0.35 . . . . 0.0 111.346 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -105.78 -41.04 5.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.232 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -130.73 -71.83 0.57 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.038 0.447 . . . . 0.0 110.636 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -112.09 -160.47 0.72 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.93 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.46 -156.9 0.6 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.272 0.229 . . . . 0.0 110.582 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.441 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -156.86 119.6 4.02 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.122 0.487 . . . . 0.0 111.953 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.441 ' NZ ' ' O ' ' A' ' 69' ' ' ASN . 20.8 mmtm -136.08 151.88 50.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.619 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 64.86 179.64 0.18 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.411 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.632 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.739 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 111.356 0.132 . . . . 0.0 111.356 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 9' ' ' VAL . 5.3 mmpt? -73.83 -179.49 3.7 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.094 0.246 . . . . 0.0 110.954 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 9' ' ' VAL . 26.9 tp60 -114.01 115.25 27.32 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.942 0.401 . . . . 0.0 111.887 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.428 ' HG3' ' NH1' ' B' ' 104' ' ' ARG . 5.9 ttm-85 -78.42 109.18 12.35 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.876 0.846 . . . . 0.0 111.773 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.81 HD11 HG11 ' B' ' 128' ' ' VAL . 0.8 OUTLIER -108.16 127.31 64.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 113.993 -1.458 . . . . 0.0 107.115 177.887 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.645 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.46 129.86 41.73 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -177.301 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.896 HG12 HD13 ' A' ' 24' ' ' ILE . 1.1 m -101.57 99.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 173.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.889 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -70.76 67.48 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.793 -0.763 . . . . 0.0 111.782 -177.695 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.851 HG22 HG22 ' B' ' 107' ' ' VAL . 3.8 m -99.67 -114.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 10.0 t0 145.74 -84.82 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -88.19 2.84 51.3 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.134 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.65 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -76.14 62.26 1.68 Allowed 'General case' 0 C--N 1.357 0.93 0 CA-C-N 119.588 1.085 . . . . 0.0 108.73 179.419 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.653 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 59.55 -25.58 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.755 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.813 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -44.49 -62.19 1.27 Allowed 'General case' 0 C--N 1.348 0.534 0 C-N-CA 123.352 0.661 . . . . 0.0 111.411 -179.648 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.576 ' N ' ' CG ' ' B' ' 114' ' ' TYR . 2.6 pp0? -49.45 -33.59 14.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.58 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.598 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -60.4 -50.18 74.61 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.861 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -52.53 -51.97 57.05 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.695 0.759 . . . . 0.0 111.557 -179.571 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.683 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -73.47 -29.02 62.26 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.193 179.556 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.54 -25.72 68.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.607 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.92 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -87.78 -41.0 13.59 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 118.608 -0.711 . . . . 0.0 109.804 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 158.68 39.04 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 177.057 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.635 HG13 ' O ' ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.1 94.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.885 ' O ' HD12 ' B' ' 124' ' ' ILE . 59.1 m-80 -67.3 71.01 0.11 Allowed 'General case' 0 N--CA 1.462 0.128 0 O-C-N 121.599 -0.688 . . . . 0.0 109.584 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.885 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.3 OUTLIER 37.59 -10.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.877 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.84 -55.99 1.14 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 120.002 1.274 . . . . 0.0 110.52 -176.764 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.547 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.16 -30.42 28.31 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.311 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.753 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.7 tm? -60.88 -61.26 2.71 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.952 0.376 . . . . 0.0 110.687 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.811 HG23 ' CG2' ' B' ' 124' ' ' ILE . 41.4 t -50.68 -64.19 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.713 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 24.7 p -50.42 -48.7 56.08 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -62.92 -50.92 68.94 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.544 HG21 ' OG1' ' A' ' 31' ' ' THR . 23.4 m -58.01 -42.69 85.78 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.06 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.919 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -59.19 -57.26 13.82 Favored 'General case' 0 C--O 1.209 -1.071 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.403 179.236 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.9 OUTLIER -49.1 -41.67 36.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.606 179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -51.91 54.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.602 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.864 ' HB3' HD21 ' A' ' 17' ' ' LEU . 8.9 tp10 -74.73 -14.57 60.74 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.684 0.278 . . . . 0.0 110.613 178.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.81 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.63 -38.02 16.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 123.211 0.604 . . . . 0.0 110.994 179.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -71.84 -53.45 13.24 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.835 0.826 . . . . 0.0 110.312 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.524 ' HA ' ' HD3' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -84.67 -41.63 16.11 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 113.969 -1.469 . . . . 0.0 113.62 -177.958 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.926 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 40.8 32.78 0.17 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.783 0.433 . . . . 0.0 111.356 -177.192 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.498 ' HG2' ' N ' ' B' ' 141' ' ' ALA . 15.9 ttp85 -179.74 151.98 0.47 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.322 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.498 ' N ' ' HG2' ' B' ' 140' ' ' ARG . . . -58.39 129.11 40.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.384 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.02 175.62 10.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.402 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -166.03 -64.09 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.41 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.46 ' HE3' ' HA ' ' B' ' 144' ' ' TRP . 0.0 OUTLIER 62.54 -81.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 179.444 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.04 -45.4 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.51 ' O ' HG13 ' B' ' 146' ' ' VAL . 7.6 p -76.81 90.34 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-O 121.344 0.592 . . . . 0.0 110.961 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -105.69 99.53 9.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.433 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.3 78.64 1.14 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.01 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -179.61 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.548 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -117.53 -140.74 0.36 Allowed 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.93 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.04 -78.29 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.567 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.564 ' SD ' HG11 ' B' ' 155' ' ' VAL . 8.8 mmt 70.56 99.12 0.06 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 122.756 0.422 . . . . 0.0 111.709 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.554 HG23 ' H ' ' B' ' 154' ' ' GLU . 4.6 m -120.6 -59.13 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.714 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.554 ' H ' HG23 ' B' ' 153' ' ' VAL . 0.6 OUTLIER -92.44 -61.45 1.6 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.67 0.272 . . . . 0.0 110.795 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.751 ' HA ' ' CB ' ' B' ' 172' ' ' TRP . 10.3 m 41.51 36.54 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.7 119.5 24.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.255 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -145.67 -78.95 0.18 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.563 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -127.43 -56.2 1.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 45.5 mm -111.68 133.19 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.886 0.374 . . . . 0.0 111.037 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.84 70.6 9.55 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.508 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.5 mmt -138.9 115.57 10.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.441 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -74.8 58.59 0.83 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.998 0.427 . . . . 0.0 111.768 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -156.87 69.55 0.28 Allowed Glycine 0 C--N 1.332 0.358 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.387 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.1 p -162.8 78.7 0.47 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.619 0.247 . . . . 0.0 111.122 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -157.18 78.2 0.88 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 39' ' ' LEU . . . -95.09 -108.15 0.14 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -65.71 -48.35 72.27 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.282 0.563 . . . . 0.0 109.498 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -117.65 128.78 55.25 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.661 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -71.4 -87.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.058 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.531 ' O ' ' HA ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -170.87 -101.12 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.485 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -157.43 -55.94 0.08 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.635 0.255 . . . . 0.0 110.511 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.751 ' CB ' ' HA ' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.921 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-C2' 107.146 0.951 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.925 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.545 0 C4'-C3'-C2' 101.671 -1.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.925 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 C3'-C2'-C1' 105.494 1.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.543 ' C6 ' " C2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.76 0 C4'-C3'-C2' 104.526 1.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.621 " H2'" ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.001 0 C3'-C2'-C1' 105.27 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.621 ' H72' " H2'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C4'-C3'-C2' 104.255 1.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.569 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.761 0 C3'-C2'-C1' 106.416 2.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.569 ' H72' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C3'-C2'-C1' 102.128 -0.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.432 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C1'-C2' 107.154 0.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.591 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.854 0 C3'-C2'-C1' 105.056 1.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-C2' 107.174 0.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.576 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.173 0.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . 0.459 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C1'-O4'-C4' 110.42 0.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.457 ' H71' " H2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 107.268 1.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.554 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.111 0.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.806 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 C1'-O4'-C4' 110.547 0.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.841 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 P--O5' 1.597 0.373 0 C1'-O4'-C4' 110.833 0.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.55 ' OP2' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.002 0 C4'-C3'-C2' 104.74 1.54 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.618 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 105.239 1.814 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.485 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.695 0 C3'-C2'-C1' 105.846 2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.485 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C4'-C3'-C2' 104.603 1.403 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.47 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C1'-O4'-C4' 110.706 0.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.47 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.048 0 C1'-O4'-C4' 107.748 -1.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.559 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 O4'-C1'-C2' 106.991 0.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.559 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.792 0 C4'-C3'-C2' 104.186 0.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C1'-O4'-C4' 110.285 0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.532 0.206 . . . . 0.0 111.539 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.594 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 20.7 mmtm -148.15 143.02 26.81 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.746 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.654 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -112.85 114.54 27.11 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 120.927 0.394 . . . . 0.0 111.449 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.9 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.49 104.67 10.26 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.156 -0.618 . . . . 0.0 110.824 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.86 HD13 ' CD1' ' B' ' 114' ' ' TYR . 1.4 pt -109.41 127.92 65.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.869 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.9 141.74 48.54 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 117.955 -1.498 . . . . 0.0 113.316 -178.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 1.049 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.41 102.39 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.525 -1.216 . . . . 0.0 109.16 177.634 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.956 HG23 HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -70.18 76.92 0.52 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.815 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.2 p -110.67 -128.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.907 -176.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.808 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 5.3 t70 94.76 23.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 122.841 1.305 . . . . 0.0 109.399 -175.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 9' ' ' VAL . 12.3 t -150.24 -50.47 0.13 Allowed 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 112.746 -2.025 . . . . 0.0 110.486 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.715 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 5.6 m-20 -79.16 46.3 0.7 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.465 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 68.9 m 66.82 9.77 7.03 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.815 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -60.75 -50.74 72.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.969 1.258 . . . . 0.0 111.001 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 14.3 mm-40 -48.95 -32.46 9.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.735 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -64.81 -56.49 13.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.277 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.768 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.29 -56.08 8.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.275 0.559 . . . . 0.0 112.187 -178.306 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 15' ' ' GLN . 5.1 pttp -69.21 -25.98 64.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.491 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.13 -26.74 65.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.07 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.958 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -87.54 -38.57 15.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.725 -0.655 . . . . 0.0 109.664 178.812 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 156.69 25.04 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 177.156 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 24' ' ' ILE . 54.4 t -147.89 82.87 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 3.0 m-20 -64.65 63.79 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.939 0.4 . . . . 0.0 110.593 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.987 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 40.96 -13.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 23' ' ' ASN . 10.1 t -38.25 -61.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 119.862 1.21 . . . . 0.0 110.337 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -78.89 -36.13 29.38 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.031 178.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.546 HD13 HD11 ' A' ' 17' ' ' LEU . 7.9 tp -56.58 -61.87 2.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.766 0.317 . . . . 0.0 110.183 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.119 HG22 HG22 ' B' ' 128' ' ' VAL . 2.7 t -50.21 -64.52 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.176 178.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.685 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 26.5 p -49.36 -45.34 45.69 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -70.06 -42.94 72.17 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.583 HG21 ' OG1' ' B' ' 131' ' ' THR . 35.2 m -61.49 -42.78 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.038 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.853 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.4 mmt -50.27 -50.67 49.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.505 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.42 -45.15 95.52 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.145 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.505 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.74 -52.59 59.79 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.722 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 1.044 ' HG2' HD11 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -61.61 -37.1 82.7 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.154 178.714 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.852 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -66.23 -38.94 89.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.704 178.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -73.2 -56.1 5.56 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.397 0.618 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.29 -36.6 39.43 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.183 -177.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.223 HD11 ' CE2' ' B' ' 120' ' ' TYR . 61.1 mt 33.02 -104.31 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.202 0.601 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 35.3 ttt85 60.2 21.78 11.12 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 178.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 72.58 162.12 0.25 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.332 0.587 . . . . 0.0 112.308 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -92.23 172.12 8.63 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.51 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.731 ' HB2' ' CZ ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -119.66 136.96 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.922 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.46 156.06 33.36 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.906 0.384 . . . . 0.0 111.149 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -55.53 123.31 13.55 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.291 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.8 157.13 4.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 120.988 0.423 . . . . 0.0 110.987 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -71.71 146.76 47.98 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.585 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.31 -52.84 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.152 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 67.58 59.69 0.48 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.049 0.452 . . . . 0.0 111.597 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 57.51 39.73 27.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.202 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 175.75 166.7 33.64 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.128 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 33.6 mtm 57.1 61.94 2.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.865 0.364 . . . . 0.0 111.966 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.63 HG22 ' HG2' ' A' ' 54' ' ' GLU . 8.0 p -163.0 146.86 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.717 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 0.0 OUTLIER 49.67 -173.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.731 179.455 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.65 HG23 ' CE2' ' A' ' 72' ' ' TRP . 0.6 OUTLIER -139.65 -71.94 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.865 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 60.49 122.79 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -174.74 142.84 0.73 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 36.6 t80 70.84 -51.7 0.68 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 126.68 33.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.042 0.449 . . . . 0.0 111.974 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.26 149.75 24.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.074 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.506 ' O ' HG12 ' B' ' 146' ' ' VAL . 0.0 OUTLIER -122.91 -20.65 5.76 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.748 ' HA ' ' HB2' ' A' ' 68' ' ' GLU . 2.8 p30 -52.88 159.39 1.15 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.429 0.633 . . . . 0.0 112.672 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.907 ' HA3' HG13 ' B' ' 146' ' ' VAL . . . 167.39 -22.44 0.11 Allowed Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.527 -0.76 . . . . 0.0 114.353 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 95.8 p -171.55 -179.71 2.63 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 117.983 0.891 . . . . 0.0 112.25 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 70.67 28.16 3.55 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.177 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 53.49 24.4 4.02 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.439 ' OD2' ' HA ' ' B' ' 139' ' ' LEU . 20.9 t70 -173.63 -141.9 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.916 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.748 ' HB2' ' HA ' ' A' ' 62' ' ' ASN . 2.2 pt-20 -170.11 148.12 3.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.111 0.481 . . . . 0.0 111.513 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.614 ' HA ' ' HG3' ' B' ' 135' ' ' GLU . 2.2 t-20 -83.2 -158.82 0.31 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.902 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 61' ' ' MET . 22.9 mttt -101.09 172.52 6.96 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.495 0.664 . . . . 0.0 112.663 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -115.64 -35.87 4.41 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.533 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.908 ' CZ3' HG21 ' B' ' 153' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.398 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.35 175.73 8.89 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.557 0.218 . . . . 0.0 110.781 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.808 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 2.9 tt0 -122.49 119.88 32.24 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.076 0.465 . . . . 0.0 111.725 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.956 HH11 HG23 ' A' ' 8' ' ' THR . 9.9 ttt85 -79.64 117.95 21.02 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.795 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.831 HD11 HG11 ' B' ' 128' ' ' VAL . 0.5 OUTLIER -111.07 116.64 53.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.741 -179.656 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.869 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.11 126.06 54.21 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -176.26 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 107' ' ' VAL . 0.2 OUTLIER -100.86 85.78 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 175.425 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.9 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -56.03 98.39 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -179.655 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.998 HG11 ' CB ' ' B' ' 114' ' ' TYR . 14.9 p -110.36 -137.75 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.562 -175.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.747 ' H ' HG22 ' B' ' 109' ' ' VAL . 31.1 t70 89.14 -7.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -174.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.61 -65.51 1.14 Allowed 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.313 -1.312 . . . . 0.0 107.912 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.685 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -38.72 -84.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.244 0.34 . . . . 0.0 111.26 179.621 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.3 OUTLIER 173.9 45.86 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 121.123 0.487 . . . . 0.0 110.937 179.678 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.998 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.7 OUTLIER -83.35 -40.86 18.89 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.623 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.82 -40.59 21.54 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.707 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.852 HD22 ' HB1' ' A' ' 36' ' ' ALA . 1.4 mt -50.33 -33.48 20.38 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -78.4 -51.11 10.54 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.522 0.677 . . . . 0.0 111.648 178.705 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.623 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -70.46 -25.88 63.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.45 -27.85 50.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.019 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.223 ' CE2' HD11 ' A' ' 39' ' ' LEU . 2.8 m-30 -88.47 -40.75 13.23 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.303 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.3 t0 115.31 57.74 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.155 0.978 . . . . 0.0 111.547 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' B' ' 124' ' ' ILE . 92.0 t -118.34 -19.86 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.043 -179.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.612 ' O ' HD12 ' B' ' 124' ' ' ILE . 36.0 m-20 41.38 23.25 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.799 0.333 . . . . 0.0 111.562 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.874 HG22 HD22 ' B' ' 127' ' ' LEU . 2.4 pp 21.99 45.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 177.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.766 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 p -62.97 -63.72 1.12 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.813 176.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.443 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -81.15 -16.56 74.11 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.769 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 1.044 HD11 ' HG2' ' A' ' 35' ' ' GLU . 1.9 tp -66.82 -52.91 38.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.73 0.265 . . . . 0.0 111.235 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.119 HG22 HG22 ' A' ' 28' ' ' VAL . 35.0 t -53.57 -67.69 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.719 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.6 p -50.8 -36.64 38.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -63.06 -51.68 65.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.583 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.8 m -58.22 -31.73 67.63 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.081 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 14' ' ' TYR . 5.4 mmt -65.54 -54.71 24.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.482 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -49.94 -41.53 46.56 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.19 -54.0 44.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 116.833 -0.167 . . . . 0.0 110.749 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.1 mt-10 -75.08 -8.84 57.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.551 178.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -79.47 -47.31 15.85 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.224 -1.399 . . . . 0.0 107.224 176.079 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.9 74.54 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.398 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' B' ' 139' ' ' LEU . 7.7 tpt180 -63.44 -42.12 98.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.219 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.958 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -16.66 116.73 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.936 0.894 . . . . 0.0 113.059 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -156.71 -62.88 0.1 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.134 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -164.91 163.99 20.87 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.011 0.434 . . . . 0.0 111.751 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.442 ' O ' ' NH1' ' B' ' 143' ' ' ARG . 1.9 pm0 -96.18 -173.67 2.87 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.978 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.442 ' NH1' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -176.12 -152.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 178.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.434 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 1.3 p90 -147.1 143.19 28.12 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.713 0.292 . . . . 0.0 111.688 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 80.59 105.23 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.128 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.907 HG13 ' HA3' ' A' ' 63' ' ' GLY . 0.2 OUTLIER -121.07 121.67 65.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.829 179.243 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -14.23 49.83 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.9 m120 65.15 45.64 2.95 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.071 0.462 . . . . 0.0 111.619 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.65 120.41 42.14 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' GLU . . . . . 0.501 ' HG3' ' OD1' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -83.07 172.6 12.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.535 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -70.58 176.85 34.75 Favored Glycine 0 CA--C 1.522 0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.812 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -166.97 55.36 0.08 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.941 0.401 . . . . 0.0 111.995 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.908 HG21 ' CZ3' ' A' ' 72' ' ' TRP . 4.4 p -113.58 88.15 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 121.118 0.485 . . . . 0.0 111.021 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.777 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.433 HG22 ' O ' ' B' ' 155' ' ' VAL . 11.8 p -159.37 45.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.539 0.685 . . . . 0.0 111.155 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.05 -152.43 0.24 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.424 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.22 174.42 1.33 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.716 0.293 . . . . 0.0 110.862 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.99 95.45 0.12 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.943 0.402 . . . . 0.0 111.452 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.489 HG23 ' O ' ' B' ' 159' ' ' ILE . 3.4 tp -163.98 55.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.319 0.581 . . . . 0.0 111.298 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -164.7 159.52 18.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 9.7 mtt -65.36 86.07 0.07 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.049 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -75.58 165.76 24.59 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.124 0.488 . . . . 0.0 112.062 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 142.36 -136.71 7.38 Favored Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.257 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' B' ' 165' ' ' PHE . 38.3 t 61.0 -149.96 0.41 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.438 ' N ' ' OG ' ' B' ' 164' ' ' SER . 90.9 t80 -133.22 -54.54 0.91 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -122.53 -96.72 0.46 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.507 ' OD1' ' HB3' ' A' ' 39' ' ' LEU . 6.6 t0 -87.25 93.17 9.31 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.244 0.545 . . . . 0.0 111.503 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.407 ' HB3' ' CB ' ' B' ' 164' ' ' SER . 8.9 tt0 -169.59 92.27 0.24 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.388 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.447 ' O ' ' HB1' ' A' ' 41' ' ' ALA . 2.3 t30 -173.15 -168.35 0.46 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.772 0.32 . . . . 0.0 111.614 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -167.18 92.53 0.42 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.127 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -96.01 -83.68 0.37 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.966 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.363 -0.827 . . . . 0.0 111.82 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.781 " H1'" " O4'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.527 0.873 0 C3'-C2'-C1' 105.538 2.027 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.781 " O4'" " H1'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.526 0.791 0 C3'-C2'-C1' 106.067 2.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.491 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C4'-C3'-C2' 104.203 1.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.575 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.949 0 C1'-O4'-C4' 107.527 -1.552 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.669 " H2'" ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.027 0 C3'-C2'-C1' 105.382 1.916 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.705 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C4'-C3'-C2' 104.348 1.148 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.705 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.741 0 C3'-C2'-C1' 105.582 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.656 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.301 0.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.462 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.703 0 C3'-C2'-C1' 104.249 1.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.504 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.794 0 C3'-C2'-C1' 105.306 1.862 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 N19-C1'-C2' 113.272 -0.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.455 ' C5 ' ' C2 ' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 O4'-C4'-C3' 106.116 0.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 107.459 1.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.484 H5'' ' C5 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 N19-C1'-C2' 116.251 1.282 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.491 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.61 -0.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.491 ' C8 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.622 0 O4'-C1'-C2' 106.872 0.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.468 ' P ' ' HD2' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C4'-C3'-C2' 104.281 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.503 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.909 0 C1'-O4'-C4' 107.016 -1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.715 " H3'" ' O ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.603 0 C3'-C2'-C1' 105.139 1.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.349 1.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.632 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.746 0 C3'-C2'-C1' 105.606 2.076 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.632 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 C3'-C2'-C1' 104.599 1.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.529 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.879 0 C4'-C3'-C2' 104.573 1.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.447 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.498 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.737 0 O4'-C1'-C2' 104.807 -1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C1'-O4'-C4' 110.32 0.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.475 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 120.772 0.32 . . . . 0.0 111.478 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER 73.74 115.02 0.06 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.717 -179.511 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' B' ' 109' ' ' VAL . 1.2 tt0 -95.89 106.56 18.72 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.446 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.892 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.7 OUTLIER -78.87 99.86 6.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.738 -179.486 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.806 ' CG1' HD11 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -102.96 110.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 177.426 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.77 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.5 123.65 47.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 -175.645 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.647 HG22 ' CG2' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -100.16 105.66 17.96 Favored 'Isoleucine or valine' 0 C--N 1.344 0.337 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 176.286 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.635 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 2.0 p -70.08 90.46 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.028 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.1 t -78.08 -125.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.754 -177.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.585 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.6 t70 86.28 -5.34 0.76 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.292 0.568 . . . . 0.0 110.316 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.8 t -144.92 -52.0 0.28 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.335 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.794 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -44.78 -90.89 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.623 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' B' ' 129' ' ' SER . 1.6 m 177.85 34.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.392 -0.818 . . . . 0.0 111.133 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.028 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -84.05 -46.1 12.36 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.032 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.569 ' HA ' ' HG2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.12 -42.28 28.79 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.977 -176.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.89 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -60.29 -57.92 10.73 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.556 0.616 . . . . 0.0 111.82 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.093 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -60.34 -35.76 76.4 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.633 -178.377 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.784 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.74 -32.13 41.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.373 0.606 . . . . 0.0 112.117 -179.522 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.616 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -82.1 -16.88 48.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.267 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.008 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -87.98 -33.32 18.45 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.212 179.377 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' A' ' 67' ' ' ASP . 0.5 OUTLIER 172.88 -19.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.871 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.784 ' O ' ' HA ' ' A' ' 18' ' ' LYS . 17.0 t -97.19 -179.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.255 0.55 . . . . 0.0 110.168 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.053 ' O ' HD12 ' A' ' 24' ' ' ILE . 20.8 m120 -160.67 43.94 0.19 Allowed 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 177.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.053 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.96 -4.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 113.022 -1.899 . . . . 0.0 115.921 -177.45 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.607 ' OG ' " H4'" ' D' ' 189' ' ' ' DG' . 1.4 t -39.02 -63.79 0.5 Allowed 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.09 0.859 . . . . 0.0 109.675 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.587 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -86.76 -25.36 35.39 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.941 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.821 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -59.49 -62.36 1.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.438 0.619 . . . . 0.0 110.279 179.623 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.797 HG22 HG21 ' B' ' 124' ' ' ILE . 16.2 t -50.59 -59.26 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.787 0.804 . . . . 0.0 109.383 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 1.4 t -50.12 -52.58 33.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.0 OUTLIER -74.14 -50.96 17.12 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 117.762 0.255 . . . . 0.0 110.435 -177.89 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.579 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -54.17 -49.16 69.93 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.916 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.917 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 14.9 mtt -54.77 -48.16 73.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.189 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -45.35 73.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.413 0.149 . . . . 0.0 110.778 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -61.93 -57.1 13.03 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.7 OUTLIER -58.27 -33.61 69.6 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.692 178.449 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 39' ' ' LEU . . . -70.41 -48.81 54.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.519 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -52.63 64.78 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.369 0.604 . . . . 0.0 111.135 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -78.57 -18.02 55.27 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.918 -177.669 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.105 HD21 ' CD2' ' B' ' 120' ' ' TYR . 0.8 OUTLIER -20.95 106.89 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.515 0.726 . . . . 0.0 112.327 -179.732 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.525 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 31.1 mtm-85 95.25 -10.66 0.1 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.636 0.775 . . . . 0.0 112.623 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 38' ' ' ARG . . . -129.07 -174.26 3.21 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.714 0.292 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -144.48 -163.16 1.63 Allowed 'General case' 0 CA--C 1.538 0.498 0 O-C-N 122.367 -0.208 . . . . 0.0 111.406 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.88 43.88 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.848 0.356 . . . . 0.0 111.53 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.0 60.86 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.86 138.43 15.04 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.938 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.567 HG21 HG23 ' A' ' 55' ' ' VAL . 7.2 p -130.91 133.17 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.38 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -103.96 110.42 22.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.26 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -171.55 -72.41 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.81 -179.98 5.81 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.004 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -75.18 67.81 1.86 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.137 0.494 . . . . 0.0 111.072 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.12 148.16 20.65 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.598 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 65.7 mtm -81.09 -71.67 0.46 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.3 t -135.5 -27.51 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.912 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.584 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.3 pm0 -81.52 131.56 35.28 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.215 0.531 . . . . 0.0 111.87 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.567 HG23 HG21 ' A' ' 46' ' ' VAL . 2.9 p -125.01 82.96 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.441 0.639 . . . . 0.0 110.594 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -109.02 134.89 51.06 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.854 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.571 ' HD2' HG21 ' B' ' 146' ' ' VAL . 0.0 OUTLIER -179.41 148.17 0.34 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.494 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.418 ' C ' HG13 ' A' ' 59' ' ' ILE . 0.7 OUTLIER 77.96 134.96 0.06 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.418 HG13 ' C ' ' A' ' 58' ' ' PHE . 1.1 mp -141.63 114.48 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.608 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.17 63.39 0.51 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.153 0.502 . . . . 0.0 111.974 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 41.5 tpp 54.73 71.33 0.54 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.173 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.97 -150.37 0.35 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.429 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -112.46 110.73 2.65 Favored Glycine 0 C--N 1.338 0.643 0 C-N-CA 120.68 -0.772 . . . . 0.0 113.395 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -78.18 -52.39 8.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 110.581 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -119.56 171.63 8.23 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.251 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.38 -9.05 21.49 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' A' ' 21' ' ' ASP . 5.7 p-10 -101.74 168.85 9.19 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.444 ' HB3' ' NH1' ' B' ' 143' ' ' ARG . 26.7 tt0 64.6 69.02 0.52 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.947 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.35 72.72 1.41 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.76 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 5.5 tttm -65.24 -21.78 66.79 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -178.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.632 ' HA ' ' CE3' ' B' ' 144' ' ' TRP . 1.6 t70 78.36 -172.84 0.07 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.121 0.419 . . . . 0.0 111.159 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.584 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 27.3 p-90 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.677 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 4.2 mmm . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 120.628 0.252 . . . . 0.0 111.632 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.547 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 18.4 mttm -75.87 -175.24 2.92 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.637 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.585 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 43.5 tp60 -124.45 123.41 40.1 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.653 0.263 . . . . 0.0 110.99 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.575 ' HD3' ' H73' ' C' ' 178' ' ' ' DT' . 5.8 ttm105 -85.92 116.45 24.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.354 0.597 . . . . 0.0 111.949 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.739 HD11 HG11 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -114.45 125.78 71.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 177.296 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.835 HG23 ' H73' ' D' ' 191' ' ' ' DT' . 0.2 OUTLIER -131.04 125.72 33.99 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.373 -0.531 . . . . 0.0 112.354 -176.728 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.74 HG22 ' OP1' ' D' ' 190' ' ' ' DG' . 0.9 OUTLIER -102.65 98.46 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 175.19 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.892 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.5 p -70.27 93.42 0.84 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.523 0.678 . . . . 0.0 110.816 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.098 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.9 t -85.55 -141.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.008 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.0 t0 91.01 -9.69 0.28 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 5.2 m -129.03 -56.63 1.18 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.196 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 1.2 m-20 -54.68 -104.19 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -167.14 29.24 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.018 -1.051 . . . . 0.0 111.661 -179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.098 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -72.73 -38.7 67.35 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.647 1.179 . . . . 0.0 112.864 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.642 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 6.6 mt-30 -48.99 -42.27 37.29 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -175.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.626 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -56.37 -34.55 66.76 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.35 0.977 . . . . 0.0 112.857 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.917 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -70.93 -52.36 20.42 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.97 0.414 . . . . 0.0 110.68 179.528 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.86 -25.69 66.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.446 0.641 . . . . 0.0 109.467 177.805 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.08 -33.25 75.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.957 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.105 ' CD2' HD21 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.99 -29.03 21.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.925 -0.56 . . . . 0.0 110.446 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.0 t0 123.58 71.26 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.751 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -169.39 -40.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.506 ' O ' ' HE1' ' A' ' 32' ' ' MET . 14.8 m-80 64.47 -106.95 0.16 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.037 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.09 1.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 178.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.3 OUTLIER -39.47 -63.76 0.53 Allowed 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.721 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.462 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.38 -29.88 23.57 Favored Glycine 0 CA--C 1.522 0.515 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.945 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.702 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -56.88 -60.53 3.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.453 0.301 . . . . 0.0 110.813 179.187 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.037 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -53.55 -64.86 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.794 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 12.8 p -49.21 -43.96 42.84 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.8 m -72.18 -48.8 40.57 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.23 -36.87 85.07 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.025 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.093 ' HA ' HD12 ' A' ' 17' ' ' LEU . 3.7 mmt -64.42 -54.64 29.56 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.946 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.498 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -48.47 -35.67 13.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.806 -179.595 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -66.35 -57.26 7.83 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.774 ' CB ' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -73.08 -13.05 61.12 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.478 0.18 . . . . 0.0 111.189 178.626 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.89 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.84 -30.3 20.29 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 121.086 0.47 . . . . 0.0 109.807 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -82.29 -48.26 11.42 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.71 0.767 . . . . 0.0 110.686 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -17.46 61.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 114.028 -1.442 . . . . 0.0 114.095 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.008 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -41.82 149.68 0.13 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.609 0.641 . . . . 0.0 112.521 -178.726 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER 85.45 73.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.081 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -170.07 -149.53 0.07 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.506 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 172.77 13.26 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.954 0.407 . . . . 0.0 111.341 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.444 ' NH1' ' HB3' ' A' ' 68' ' ' GLU . 6.0 mmm180 -79.59 -54.4 5.93 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.618 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.632 ' CE3' ' HA ' ' A' ' 71' ' ' ASP . 3.8 m-90 61.68 -166.56 0.21 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.461 ' CB ' ' O ' ' B' ' 144' ' ' TRP . 1.4 tppt? 89.48 75.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.077 0.551 . . . . 0.0 110.783 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 1.008 HG13 ' HG2' ' B' ' 147' ' ' GLU . 8.7 p -133.08 169.81 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.549 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 1.008 ' HG2' HG13 ' B' ' 146' ' ' VAL . 0.0 OUTLIER 42.33 68.61 0.46 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.219 0.608 . . . . 0.0 112.546 -179.737 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -117.21 50.73 1.07 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.7 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -141.31 160.02 40.99 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.821 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 51.47 48.31 23.18 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.063 0.458 . . . . 0.0 111.269 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -52.37 98.29 0.03 OUTLIER Glycine 0 C--N 1.339 0.701 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.009 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.2 mtt -48.33 151.88 0.98 Allowed 'General case' 0 C--O 1.239 0.513 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.611 HG12 ' CG2' ' B' ' 155' ' ' VAL . 21.6 t -152.94 100.05 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.87 179.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.538 ' HB3' ' HB3' ' B' ' 172' ' ' TRP . 5.6 tp10 -68.08 -55.1 13.75 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.611 ' CG2' HG12 ' B' ' 153' ' ' VAL . 3.5 t 65.17 42.82 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.438 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.4 ' N ' ' CD1' ' B' ' 172' ' ' TRP . . . -53.46 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -177.13 171.86 2.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.849 -0.16 . . . . 0.0 110.876 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -64.72 93.96 0.12 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.802 0.334 . . . . 0.0 110.396 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 tt -129.73 11.05 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.282 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -126.7 -119.41 0.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.861 -0.154 . . . . 0.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.7 mtm -102.05 -83.55 0.46 Allowed 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.255 -0.278 . . . . 0.0 110.627 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -166.7 93.93 0.49 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 111.278 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -90.23 20.52 36.62 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.549 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 1.1 m -109.03 33.33 4.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.057 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -121.32 -73.69 0.64 Allowed 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 40' ' ' ARG . . . -154.11 -127.57 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.443 0.163 . . . . 0.0 111.155 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -81.99 78.98 8.62 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.094 0.474 . . . . 0.0 111.607 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -165.47 115.93 1.07 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.17 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 177.83 172.71 0.6 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.142 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -159.28 100.36 1.52 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 111.515 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.26 -154.9 0.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.073 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.538 ' HB3' ' HB3' ' B' ' 154' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.508 -0.758 . . . . 0.0 111.472 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.63 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C4'-C3'-C2' 102.597 -0.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.63 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C4'-C3'-C2' 102.759 -0.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.496 ' C5 ' ' C4 ' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 104.54 1.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.635 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.892 0 C4'-C3'-C2' 104.2 1.0 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.62 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.895 0 C4'-C3'-C2' 104.746 1.546 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.735 ' H72' HG21 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 104.591 1.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.732 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.565 0 C3'-C2'-C1' 104.63 1.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.732 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C4'-C3'-C2' 104.331 1.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.604 " O5'" ' H8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.515 0 O4'-C1'-C2' 107.188 0.989 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.648 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 105.895 2.282 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.651 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 C3'-C2'-C1' 104.791 1.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.651 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 N19-C1'-C2' 115.209 0.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 O4'-C1'-C2' 106.977 0.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C1'-C2' 107.082 0.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 106.97 0.791 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C4'-C3'-C2' 102.75 -0.45 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.688 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 C4'-C3'-C2' 101.744 -1.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.74 ' OP1' HG22 ' B' ' 107' ' ' VAL . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C4'-C3'-C2' 104.696 1.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.835 ' H73' HG23 ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C4'-C3'-C2' 104.543 1.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.433 " H2'" ' H71' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.934 0 C1'-O4'-C4' 107.477 -1.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.433 ' H71' " H2'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.735 0 C4'-C3'-C2' 105.039 1.839 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.649 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 C3'-C2'-C1' 104.144 1.032 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.649 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.9 0 C4'-C3'-C2' 104.636 1.436 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.456 ' H8 ' H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.594 0 C3'-C2'-C1' 104.42 1.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.445 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 N19-C1'-C2' 115.376 0.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.437 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 O4'-C4'-C3' 106.15 0.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.655 0.264 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -92.11 -171.24 2.77 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 179.471 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' B' ' 108' ' ' THR . 60.8 tp60 -108.79 111.15 22.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.311 0.577 . . . . 0.0 112.095 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.0 ttm-85 -79.36 103.6 9.4 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.64 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.811 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -98.1 130.34 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.066 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.076 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.794 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -131.32 130.07 42.27 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 117.799 -1.561 . . . . 0.0 114.191 -177.745 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 1.044 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -100.63 108.05 22.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.191 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.076 177.303 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.16 87.5 0.79 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.806 0.813 . . . . 0.0 109.477 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.074 HG21 ' CD2' ' A' ' 14' ' ' TYR . 4.7 m -71.43 -155.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.271 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.668 ' CB ' ' HA ' ' B' ' 102' ' ' LYS . 22.3 t70 91.24 -19.04 0.14 Allowed 'General case' 0 C--N 1.35 0.626 0 C-N-CA 123.689 0.795 . . . . 0.0 109.783 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.3 m -110.26 -69.6 0.86 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.852 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.647 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -51.69 -88.71 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.742 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.579 ' O ' ' HB2' ' B' ' 132' ' ' MET . 1.3 m 175.29 46.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.323 0.965 . . . . 0.0 111.874 -178.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.074 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.44 -44.72 15.69 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -179.663 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 61.5 mt-30 -47.99 -38.43 16.96 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -175.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.876 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.0 OUTLIER -61.38 -57.38 12.51 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.746 0.703 . . . . 0.0 112.669 -179.718 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.79 ' CB ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -47.31 -48.84 25.04 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.431 0.634 . . . . 0.0 112.128 -178.053 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.621 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 2.9 pttt -78.98 -29.39 43.79 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.262 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.94 -27.46 68.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.715 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.135 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.33 -43.06 11.8 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.667 -0.683 . . . . 0.0 110.445 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.5 t70 168.98 15.3 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.55 HG11 HD13 ' A' ' 27' ' ' LEU . 65.7 t -142.4 84.75 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -177.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.01 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -71.77 51.47 0.2 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.206 0.526 . . . . 0.0 110.852 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.143 HD11 HD12 ' B' ' 105' ' ' ILE . 0.9 OUTLIER 40.9 -8.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 118.97 2.952 . . . . 0.0 118.97 179.479 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.545 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 0.2 OUTLIER -38.52 -63.24 0.52 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-N 119.99 1.268 . . . . 0.0 110.439 -179.022 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.1 -28.44 34.08 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.549 178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.64 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 11.3 tp -63.3 -62.19 1.85 Allowed 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.717 0.259 . . . . 0.0 110.692 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.005 HG22 HG22 ' B' ' 128' ' ' VAL . 2.3 t -45.65 -64.61 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 O-C-N 123.373 0.421 . . . . 0.0 110.426 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.648 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 4.8 p -49.18 -35.26 16.51 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 123.136 0.273 . . . . 0.0 111.57 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 19.4 m -69.95 -52.15 26.82 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.503 ' CG2' HD11 ' B' ' 127' ' ' LEU . 86.0 m -55.89 -39.02 70.95 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.293 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.909 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.3 OUTLIER -54.84 -55.51 29.54 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.695 179.198 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -44.87 87.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.103 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.1 -50.82 62.75 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.184 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.763 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.64 -33.88 76.91 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.137 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.703 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -61.28 -45.09 95.93 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.77 -51.94 55.03 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.839 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -63.72 -35.27 80.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.055 -1.429 . . . . 0.0 113.531 -177.587 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.731 HD12 ' CD1' ' B' ' 120' ' ' TYR . 0.1 OUTLIER -25.04 -56.65 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.73 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.596 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -90.22 57.85 3.87 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.517 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' A' ' 40' ' ' ARG . . . 151.18 98.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.456 0.702 . . . . 0.0 110.935 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.459 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -86.75 -143.17 0.11 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.239 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.99 -133.9 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 122.15 -0.343 . . . . 0.0 110.83 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.495 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 3.4 m95 -127.3 143.69 51.18 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.881 0.372 . . . . 0.0 110.884 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -106.13 133.34 50.99 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.386 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.0 t 75.97 154.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.025 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.88 35.1 11.19 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.071 0.462 . . . . 0.0 111.357 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 22.2 p-10 -166.35 104.85 0.63 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.193 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -155.03 -168.66 2.95 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.082 0.468 . . . . 0.0 112.119 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.502 ' O ' ' NH1' ' B' ' 138' ' ' ARG . 25.9 mt-10 66.94 -93.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.689 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.44 132.3 0.2 Allowed Glycine 0 CA--C 1.524 0.594 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.528 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.95 169.61 17.31 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.945 0.402 . . . . 0.0 111.743 -179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.12 -64.36 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.457 ' HA ' ' HB3' ' A' ' 72' ' ' TRP . 2.3 mp0 33.18 55.67 0.47 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.354 0.597 . . . . 0.0 112.029 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.402 HG23 ' NE1' ' A' ' 72' ' ' TRP . 3.9 m -79.49 62.6 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.795 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -86.78 -31.77 20.73 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.177 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -112.34 121.03 43.72 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.299 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.93 -53.96 22.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.48 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.1 mt 66.8 -60.37 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.461 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -120.48 118.42 30.22 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.974 0.416 . . . . 0.0 110.734 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 ptt? -70.92 58.4 0.21 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.091 0.472 . . . . 0.0 111.818 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -106.32 6.99 31.07 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.691 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 59.59 -99.1 0.14 Allowed Glycine 0 C--N 1.338 0.657 0 C-N-CA 121.193 -0.527 . . . . 0.0 113.049 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 41.13 59.96 2.16 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.984 0.421 . . . . 0.0 111.819 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -148.44 142.29 25.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.274 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.38 -83.69 0.39 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.111 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -162.53 129.05 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.36 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 67' ' ' ASP . 39.7 tp10 173.56 -72.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.877 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p30 42.17 57.86 3.15 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.423 ' NZ ' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -167.86 147.76 4.97 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 179.212 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.13 69.21 0.74 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.98 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.457 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 5.2 m95 . . . . . 0 C--O 1.252 1.198 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.741 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 120.437 0.161 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.668 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 10.0 mmtt -58.89 153.88 16.34 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.871 ' O ' HG22 ' A' ' 9' ' ' VAL . 16.6 tp60 -121.19 125.8 48.08 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 121.66 0.743 . . . . 0.0 111.609 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.502 ' NE ' ' H73' ' C' ' 178' ' ' ' DT' . 1.7 ttm180 -83.81 116.62 22.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.317 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.143 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -94.53 123.48 46.66 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.313 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.659 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -131.07 111.93 12.44 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.482 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.811 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.56 98.25 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 175.783 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.976 HG22 ' HG3' ' A' ' 4' ' ' ARG . 72.1 p -68.25 93.44 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.842 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.067 HG21 ' CB ' ' B' ' 114' ' ' TYR . 6.3 t -80.57 -125.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.143 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.688 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.6 t70 83.21 -15.22 0.66 Allowed 'General case' 0 C--N 1.349 0.557 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -176.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.11 -59.25 1.42 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.997 177.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.66 ' HB2' HG13 ' B' ' 109' ' ' VAL . 1.2 m-20 -46.24 -98.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' MET . 24.9 t -175.6 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.461 -0.774 . . . . 0.0 110.504 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.067 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -81.63 -46.58 14.17 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.014 0.926 . . . . 0.0 113.406 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.94 -40.78 31.54 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.797 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.703 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -53.66 -25.35 17.66 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.661 0.664 . . . . 0.0 112.385 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.11 -60.43 2.37 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.711 0.767 . . . . 0.0 110.269 178.472 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.7 pttt -62.4 -25.11 67.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.19 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.64 -23.93 19.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.18 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.731 ' CD1' HD12 ' A' ' 39' ' ' LEU . 65.9 m-85 -87.52 -50.98 6.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 24.0 t0 136.83 54.52 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 O-C-N 124.726 1.266 . . . . 0.0 109.913 179.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.625 ' CG1' HD13 ' B' ' 117' ' ' LEU . 7.1 p -154.1 87.1 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.095 -178.014 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.948 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -70.55 52.9 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.948 HD12 ' O ' ' B' ' 123' ' ' ASN . 1.3 pp 29.08 10.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 119.433 3.123 . . . . 0.0 119.433 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 125' ' ' SER . . . . . 1.044 ' HA ' HG22 ' A' ' 7' ' ' VAL . 3.2 p -37.24 -60.91 0.62 Allowed 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 122.765 0.426 . . . . 0.0 110.891 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.725 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.95 -19.55 61.05 Favored Glycine 0 C--O 1.222 -0.644 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.279 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.725 HD12 ' CG2' ' B' ' 124' ' ' ILE . 2.7 tm? -67.36 -56.44 9.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 117.151 0.476 . . . . 0.0 110.745 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.005 HG22 HG22 ' A' ' 28' ' ' VAL . 95.5 t -59.06 -68.65 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 120.951 0.405 . . . . 0.0 110.157 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.647 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 56.3 p -50.32 -38.24 40.66 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.725 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -82.57 -50.02 9.25 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.177 1.353 . . . . 0.0 111.413 -179.286 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -51.43 -31.44 22.97 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.973 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.79 ' SD ' ' CB ' ' A' ' 17' ' ' LEU . 2.1 mmt -61.3 -50.57 72.44 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.227 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.573 ' CB ' ' CB ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -49.94 -40.32 43.24 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.518 0.599 . . . . 0.0 111.171 179.4 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -68.18 -49.41 61.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.773 ' HB2' HD21 ' A' ' 17' ' ' LEU . 4.3 mm-40 -77.28 -18.94 57.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.862 0.363 . . . . 0.0 110.532 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.876 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -75.21 -34.97 61.53 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -56.14 4.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 121.785 0.802 . . . . 0.0 109.516 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.502 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -64.1 -17.65 63.64 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 114.016 -1.447 . . . . 0.0 114.781 -177.506 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.135 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -44.48 -26.85 0.39 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -178.435 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.846 ' HD2' HD13 ' B' ' 139' ' ' LEU . 1.4 mpt_? -129.82 153.85 47.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.025 0.44 . . . . 0.0 111.298 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -80.31 111.57 16.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.269 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.13 79.12 1.65 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.356 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 9.5 ttm180 -175.93 141.33 0.46 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.526 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.552 ' O ' ' HB3' ' B' ' 145' ' ' LYS . 2.0 t90 -101.37 134.79 43.91 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.151 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.552 ' HB3' ' O ' ' B' ' 144' ' ' TRP . 1.9 tmpt? 74.99 136.57 0.06 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.336 0.397 . . . . 0.0 110.264 -178.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 10.9 m -132.45 128.21 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -168.39 1.95 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.648 179.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -145.72 133.85 21.56 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 111.98 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -150.76 110.96 4.15 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.659 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -154.15 166.66 32.38 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.959 0.409 . . . . 0.0 111.389 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 130.61 -84.02 0.31 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.266 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 61.66 -161.1 0.3 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.748 0.308 . . . . 0.0 111.523 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 2.8 t 61.85 57.34 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.206 0.526 . . . . 0.0 111.316 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -51.32 70.0 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.521 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.496 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 8.8 t 67.71 53.85 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-O 121.446 0.641 . . . . 0.0 111.865 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.415 ' N ' ' CD1' ' B' ' 172' ' ' TRP . . . -72.58 173.89 8.29 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 32.3 mmt-85 -93.7 -45.87 7.5 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.192 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 68.81 176.85 0.27 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.995 0.426 . . . . 0.0 111.894 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -144.37 -56.29 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.561 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.71 147.1 29.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -84.85 0.39 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.155 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.89 -163.22 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.557 0.218 . . . . 0.0 111.337 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 146.66 -173.16 26.99 Favored Glycine 0 C--N 1.337 0.617 0 C-N-CA 120.474 -0.87 . . . . 0.0 114.025 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 1.3 m -103.33 -95.82 0.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.204 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -151.91 67.58 0.87 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.025 0.441 . . . . 0.0 111.704 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . 59.95 17.09 6.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 111.575 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.03 -96.42 0.47 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.363 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.54 86.88 0.2 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.187 0.518 . . . . 0.0 110.254 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -167.74 161.59 13.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.413 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.509 ' O ' ' HE3' ' B' ' 170' ' ' LYS . 0.1 OUTLIER 79.85 83.58 0.05 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.691 179.327 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -141.4 -168.33 2.61 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.57 179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.496 ' CE2' ' HA ' ' B' ' 155' ' ' VAL . 1.9 m-90 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.724 -0.655 . . . . 0.0 111.86 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.449 H2'' " H5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.755 0 C3'-C2'-C1' 105.939 2.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.688 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 C4'-C3'-C2' 101.763 -1.437 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.688 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.508 0 C3'-C2'-C1' 104.714 1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.471 ' H72' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.865 0 O4'-C1'-C2' 104.847 -1.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.552 ' OP1' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.425 -0.95 0 C4'-C3'-C2' 104.624 1.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.656 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.992 0 C1'-O4'-C4' 107.294 -1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.651 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.552 0 C3'-C2'-C1' 104.663 1.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.651 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 103.966 0.766 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.443 " O5'" ' H8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 C3'-C2'-C1' 104.072 0.98 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.657 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.764 0 C3'-C2'-C1' 105.485 1.989 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.657 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O4'-C1'-C2' 107.14 0.945 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.63 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 101.491 -0.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . 0.442 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 110.271 0.408 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.715 0.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.439 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 N19-C1'-C2' 113.242 -0.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.546 H2'' ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 C3'-C2'-C1' 104.256 1.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.546 ' C8 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C4'-C3'-C2' 104.215 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.625 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C3'-C2'-C1' 105.383 1.916 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.625 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 O4'-C4'-C3' 104.229 -1.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.558 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.685 0 C3'-C2'-C1' 104.121 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.433 ' H71' " H2'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 C4'-C3'-C2' 104.973 1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.683 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C3'-C2'-C1' 104.214 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.683 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C1'-O4'-C4' 107.348 -1.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.246 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.491 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 N19-C1'-C2' 115.362 0.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.404 ' C2 ' ' N1 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C4'-C3'-C2' 103.73 0.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ttp . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.385 0.136 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.514 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 5.2 mtmt -116.96 152.9 33.58 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.581 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.682 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 20.1 tp60 -118.46 113.78 21.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.029 0.442 . . . . 0.0 111.08 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.797 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.96 107.98 13.17 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.746 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.992 HD13 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -112.78 128.05 69.69 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.779 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -127.87 136.26 51.16 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.53 -177.022 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 1.063 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.65 106.89 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.326 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 3.2 p -70.37 91.74 0.77 Allowed 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.721 -0.392 . . . . 0.0 109.957 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.979 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.3 t -85.39 -139.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.112 -178.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.549 ' H ' HG12 ' A' ' 9' ' ' VAL . 24.8 t0 92.32 -10.4 0.2 Allowed 'General case' 0 C--N 1.35 0.606 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -175.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 m -129.67 -54.06 1.15 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.06 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.82 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -48.1 -99.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.863 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.505 ' N ' ' HB2' ' B' ' 129' ' ' SER . 0.2 OUTLIER -176.28 37.64 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.32 -0.863 . . . . 0.0 110.734 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.979 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.75 -35.27 26.76 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.368 1.067 . . . . 0.0 113.786 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.518 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.95 -46.25 43.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.728 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.679 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -50.64 -33.32 21.9 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.9 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 2.2 mt -74.52 -60.07 2.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.361 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.98 -26.29 68.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.716 0.77 . . . . 0.0 109.815 178.384 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -31.61 72.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.883 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.014 ' CE2' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.24 -38.73 15.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.331 179.491 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.684 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 29.8 t70 146.83 31.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.552 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 54.6 t -161.61 99.85 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 O-C-N 122.254 -0.279 . . . . 0.0 111.071 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.523 ' O ' ' HE1' ' B' ' 132' ' ' MET . 42.3 m-80 -54.3 -88.34 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.896 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -161.4 7.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.5 p -38.72 -62.74 0.58 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.551 0.614 . . . . 0.0 110.748 -177.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.4 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -84.18 -30.52 28.0 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.722 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.896 ' HB3' HG22 ' A' ' 24' ' ' ILE . 1.1 tm? -59.8 -59.91 4.68 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.782 0.291 . . . . 0.0 110.769 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.884 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -49.71 -65.4 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.902 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -49.22 -41.06 36.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.3 m -67.69 -54.08 22.43 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -40.01 94.16 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.088 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.812 ' SD ' ' CB ' ' B' ' 117' ' ' LEU . 3.5 mmt -57.97 -58.05 10.1 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.677 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.637 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.1 OUTLIER -51.86 -37.91 53.97 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.118 0.417 . . . . 0.0 111.398 179.804 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.04 -55.38 7.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.813 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -21.47 64.8 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.047 0.451 . . . . 0.0 109.81 178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -73.44 -49.18 28.26 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -51.12 69.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.769 0.795 . . . . 0.0 109.324 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.82 -49.02 74.49 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.173 -178.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 20.08 77.72 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.866 0.866 . . . . 0.0 112.629 179.636 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.92 -53.68 0.81 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.212 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -155.54 -105.34 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 67.23 142.62 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.235 0.541 . . . . 0.0 111.667 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.33 179.52 7.87 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.95 -178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.44 -170.6 1.82 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.278 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.94 -67.39 0.22 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -133.2 123.57 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.856 0.36 . . . . 0.0 111.609 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.669 ' HB3' HG13 ' B' ' 153' ' ' VAL . 0.0 OUTLIER -47.94 -65.68 0.53 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.674 179.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.76 43.3 25.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.956 0.408 . . . . 0.0 111.219 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.92 78.37 3.49 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.83 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -109.72 118.56 36.86 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.069 0.461 . . . . 0.0 111.249 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -155.27 -167.39 16.83 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.65 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.6 mmm 61.22 21.5 11.95 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 p -162.17 123.52 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.984 0.421 . . . . 0.0 111.203 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -161.09 158.12 27.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.834 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -145.48 62.87 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.971 0.415 . . . . 0.0 111.715 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.04 77.42 0.23 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.819 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.469 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -151.95 158.83 43.67 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.377 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 1.4 m-85 74.78 154.7 0.16 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.011 0.434 . . . . 0.0 111.513 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.6 mt -123.28 104.69 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.821 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.17 78.66 1.61 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.634 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 10.1 mmt -152.78 125.86 8.54 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.277 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.37 53.15 0.89 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.392 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -177.07 -64.46 0.06 OUTLIER Glycine 0 CA--C 1.524 0.615 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.836 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.91 -84.63 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 122.366 0.267 . . . . 0.0 110.65 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 55.51 24.38 6.8 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -154.77 28.68 0.43 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.659 0.266 . . . . 0.0 111.672 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 67.87 148.78 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.242 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.406 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 60.95 -173.7 0.13 Allowed 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.355 0.598 . . . . 0.0 112.016 -179.681 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -146.35 60.82 1.23 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.042 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 10.9 mmtp -133.84 154.8 50.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.0 0.429 . . . . 0.0 111.721 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -179.46 159.58 0.92 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.961 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.417 ' CE2' ' HB2' ' A' ' 54' ' ' GLU . 25.9 p-90 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.001 -1.0 . . . . 0.0 111.216 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 120.275 0.083 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 9.3 mmtm 71.21 113.85 0.05 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.594 0.559 . . . . 0.0 110.518 -179.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.717 ' OE1' HG22 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -95.98 114.88 26.64 Favored 'General case' 0 CA--C 1.495 -1.157 0 CA-C-O 121.094 0.473 . . . . 0.0 111.979 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.7 ' CZ ' HG21 ' A' ' 6' ' ' THR . 7.4 ttt-85 -79.31 98.97 6.89 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.658 -0.817 . . . . 0.0 108.998 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.717 HG22 ' OE1' ' B' ' 103' ' ' GLN . 0.3 OUTLIER -99.02 110.69 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.779 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -116.25 120.4 38.84 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.127 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.992 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.19 109.56 25.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 174.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.797 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.1 p -70.28 80.38 0.53 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.932 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.4 p -87.97 -140.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.358 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.702 ' H ' HG22 ' B' ' 109' ' ' VAL . 3.3 t70 86.44 -3.9 0.72 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 122.103 0.954 . . . . 0.0 108.854 -175.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.32 -64.91 1.09 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.152 177.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.799 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -44.48 -85.85 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.038 -179.212 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.637 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 2.2 m 176.38 39.51 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 119.011 0.823 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.932 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.58 -43.22 15.91 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.621 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.8 OUTLIER -47.65 -39.26 16.65 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -174.328 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.811 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.7 -56.04 26.78 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.444 1.02 . . . . 0.0 111.734 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.812 ' CB ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -52.11 -43.56 64.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.998 -178.326 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.621 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -79.26 -31.97 43.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.492 179.007 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -57.3 -30.21 64.55 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.493 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.765 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.45 -46.26 9.28 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 118.366 -0.826 . . . . 0.0 109.731 178.463 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.657 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 155.95 32.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.875 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.542 ' O ' HG12 ' B' ' 122' ' ' VAL . 46.4 t -145.88 84.53 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.041 ' O ' HD12 ' B' ' 124' ' ' ILE . 53.4 m-80 -68.95 61.22 0.1 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.076 0.465 . . . . 0.0 110.887 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.063 HD13 HG12 ' A' ' 7' ' ' VAL . 0.7 OUTLIER 42.57 -6.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -179.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.486 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.88 -62.86 0.58 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.789 1.177 . . . . 0.0 110.274 -179.008 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.05 -29.7 24.96 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.482 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.723 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -59.22 -61.16 2.84 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.827 0.451 . . . . 0.0 110.233 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.979 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -49.64 -59.23 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.563 179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.0 p -50.0 -39.77 42.36 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 52.2 m -70.14 -50.35 41.36 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 6.8 m -61.63 -43.73 98.31 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.086 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.9 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 7.0 mtt -59.54 -57.5 12.68 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.104 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -42.86 71.31 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.163 0.289 . . . . 0.0 111.393 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -66.76 -53.08 36.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.561 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.55 ' O ' HD12 ' B' ' 139' ' ' LEU . 5.7 tp10 -64.07 -32.67 74.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.679 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -68.05 -50.9 52.41 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.272 0.629 . . . . 0.0 111.18 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -52.39 63.83 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -53.0 -44.95 67.64 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.458 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.014 HD11 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -36.09 -51.71 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.515 0.726 . . . . 0.0 112.35 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 111.76 24.59 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.004 0.43 . . . . 0.0 111.847 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.72 112.66 2.35 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.002 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -153.77 151.23 29.34 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.084 0.469 . . . . 0.0 111.282 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -106.68 -29.75 9.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.302 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -51.18 107.93 0.21 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.414 ' NZ ' ' OE2' ' B' ' 147' ' ' GLU . 0.0 OUTLIER -152.75 131.24 12.18 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.883 0.373 . . . . 0.0 111.688 -179.473 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' B' ' 147' ' ' GLU . 7.5 p -96.46 21.58 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.716 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' B' ' 146' ' ' VAL . 0.5 OUTLIER 68.93 -62.67 0.39 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -151.35 169.23 22.48 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.006 0.432 . . . . 0.0 111.986 -179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -119.34 -79.0 0.59 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.783 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.09 -73.05 0.31 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.852 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' GLY . . . . . 0.529 ' HA2' ' HG2' ' A' ' 47' ' ' GLU . . . 110.21 47.86 0.79 Allowed Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.045 -0.598 . . . . 0.0 113.01 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.0 63.54 1.33 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.853 0.327 . . . . 0.0 111.796 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.669 HG13 ' HB3' ' A' ' 47' ' ' GLU . 27.0 m -60.02 -33.64 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.46 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.57 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . 0.0 OUTLIER -98.65 154.67 17.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.881 0.372 . . . . 0.0 110.804 179.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.05 52.96 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.215 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -101.96 119.44 38.8 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.292 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 4.9 ptt85 -71.43 66.03 0.46 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.156 0.503 . . . . 0.0 111.254 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -82.28 175.29 10.39 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.301 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 9.1 tp -128.7 144.36 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.174 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 73.97 168.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.359 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -149.69 26.91 0.82 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -84.08 96.36 8.88 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.29 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -96.23 -85.18 1.73 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.442 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 38.3 t 51.02 38.78 21.47 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -95.29 -68.49 0.8 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.85 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -155.7 -122.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.54 66.64 5.07 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.066 0.46 . . . . 0.0 111.545 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 59.97 -167.49 0.17 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.1 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -150.22 152.53 34.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.249 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.16 137.09 42.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.938 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.67 -179.8 4.98 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.734 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.57 ' HB2' ' HB2' ' B' ' 154' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.08 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.089 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C1'-O4'-C4' 110.233 0.38 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.751 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C1'-C2' 106.779 0.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.751 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 104.535 1.311 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.504 ' H71' " H2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.653 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.047 0 C4'-C3'-C2' 104.697 1.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.653 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.534 0.649 0 C4'-C3'-C2' 104.154 0.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.583 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.765 0 C3'-C2'-C1' 105.853 2.252 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.923 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C3'-C2'-C1' 101.306 -0.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.923 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 O4'-C1'-C2' 107.159 0.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.626 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.761 0 C3'-C2'-C1' 105.494 1.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.678 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 O4'-C1'-C2' 106.938 0.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.678 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C3'-C2'-C1' 101.94 -0.543 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.267 1.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.556 " H5'" ' C5 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 N19-C1'-C2' 115.573 0.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.556 ' C5 ' " H5'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.591 -0.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.936 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C1'-O4'-C4' 110.4 0.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.936 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.509 0 O4'-C1'-C2' 107.128 0.935 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.54 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.877 0 C1'-O4'-C4' 106.406 -2.353 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.663 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C3'-C2'-C1' 104.829 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.567 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C3'-C2'-C1' 105.01 1.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.678 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.412 -0.619 0 C3'-C2'-C1' 105.182 1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.521 " O5'" H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O4'-C1'-C2' 107.462 1.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.467 H2'' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.664 -1.454 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.719 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 C3'-C2'-C1' 104.753 1.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.719 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.289 0.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 C3'-C2'-C1' 101.954 -0.533 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 120.072 -0.013 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.96 161.32 2.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.267 0.354 . . . . 0.0 111.218 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.539 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 44.2 tp60 -123.67 118.44 27.26 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.372 0.606 . . . . 0.0 112.057 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.04 115.28 18.61 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.308 179.191 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.718 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -110.18 123.24 65.91 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.458 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.31 126.03 34.29 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.579 -177.017 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.799 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -102.13 107.15 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.625 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.651 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 3.5 p -70.86 89.38 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.143 0.497 . . . . 0.0 110.864 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.182 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.9 m -83.25 -150.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.808 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.569 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 25.5 t0 94.82 -7.87 0.11 Allowed 'General case' 0 C--N 1.348 0.519 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -127.98 -59.6 1.18 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.466 -1.243 . . . . 0.0 108.854 176.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.16 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.44 ' CB ' ' HZ3' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -175.41 38.35 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.288 0.949 . . . . 0.0 111.107 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.182 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.98 -44.88 16.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.171 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.581 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 13.1 mt-30 -49.24 -43.72 42.97 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.658 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -53.25 -30.97 41.19 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 118.589 0.632 . . . . 0.0 112.132 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.966 ' CD1' HD22 ' A' ' 27' ' ' LEU . 1.7 mt -77.78 -51.77 9.99 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.988 0.423 . . . . 0.0 111.69 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.668 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -65.79 -25.35 67.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.411 0.624 . . . . 0.0 110.199 178.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.55 -31.02 55.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.747 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.57 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 46.1 m-85 -88.63 -39.82 13.78 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.22 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.2 t70 118.33 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.474 1.13 . . . . 0.0 110.149 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.546 ' HB ' HD22 ' A' ' 17' ' ' LEU . 64.6 t -130.59 -47.5 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.156 0 CA-C-N 113.979 -1.464 . . . . 0.0 109.46 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.598 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.8 m120 58.3 -113.86 0.73 Allowed 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.111 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.959 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.0 -0.45 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 115.872 1.805 . . . . 0.0 115.872 -179.556 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.539 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 9.2 t -39.78 -64.44 0.49 Allowed 'General case' 0 C--O 1.24 0.59 0 C-N-CA 119.575 -0.85 . . . . 0.0 109.968 -178.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.534 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -81.45 -27.06 49.39 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.245 178.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.966 HD22 ' CD1' ' A' ' 17' ' ' LEU . 5.3 tp -62.5 -61.52 2.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.768 0.284 . . . . 0.0 111.008 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.823 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.7 t -51.83 -70.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.755 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 38.5 p -47.68 -42.53 25.02 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.534 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -74.57 -45.64 44.08 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 119.032 0.833 . . . . 0.0 109.778 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.571 HG23 HD11 ' B' ' 127' ' ' LEU . 0.5 OUTLIER -68.47 -27.92 66.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.568 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.887 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.5 mmt -57.08 -55.63 32.22 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.368 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.47 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.63 -53.34 53.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.03 0.443 . . . . 0.0 110.42 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.47 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 1.9 m-20 -57.28 -50.83 71.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.049 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HG3' HD21 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -68.43 -30.27 69.11 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.13 0.491 . . . . 0.0 109.874 177.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.73 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -67.04 -43.26 83.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.065 0.459 . . . . 0.0 110.374 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -78.91 -54.67 5.82 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.273 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.452 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 9.2 tpp180 -79.31 -31.24 43.17 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 114.662 -1.154 . . . . 0.0 114.039 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.635 ' CD1' ' HB2' ' B' ' 167' ' ' ASP . 0.1 OUTLIER 26.2 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.691 0.758 . . . . 0.0 112.704 -178.289 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.591 ' HB2' ' HG3' ' A' ' 42' ' ' GLU . 8.6 mmm180 -113.01 -18.5 12.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.009 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 58.73 33.31 22.98 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.189 0.519 . . . . 0.0 110.544 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.605 ' HB3' ' CD1' ' A' ' 44' ' ' TRP . 10.4 mt-10 -73.93 72.34 1.6 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.866 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.515 ' HA ' HG21 ' B' ' 130' ' ' THR . 2.4 ptp85 -70.72 64.8 0.31 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.358 0.599 . . . . 0.0 110.208 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.677 ' HA ' ' HG2' ' B' ' 149' ' ' GLN . 10.3 m95 -68.64 64.38 0.11 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.342 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -170.69 154.87 4.6 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.162 0.506 . . . . 0.0 112.165 179.257 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.573 ' N ' ' HD2' ' A' ' 45' ' ' LYS . 5.9 p -162.61 -51.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.058 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' N ' HG13 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -172.25 152.07 2.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.141 179.441 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -145.25 86.74 1.78 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 111.929 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -113.07 -34.79 5.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.494 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.51 97.88 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.034 0.445 . . . . 0.0 111.058 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.76 -166.31 20.38 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.124 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.16 95.91 0.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.789 0.328 . . . . 0.0 111.265 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.06 129.36 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.585 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.618 ' O ' HG13 ' A' ' 55' ' ' VAL . 46.0 mm-40 -106.48 -169.44 1.56 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.218 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.799 ' HA ' ' CD1' ' A' ' 72' ' ' TRP . 0.1 OUTLIER -164.44 35.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.107 0.48 . . . . 0.0 111.315 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.73 64.7 0.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.109 0.48 . . . . 0.0 111.441 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.5 38.1 4.18 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.436 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.21 158.39 17.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.048 0.451 . . . . 0.0 111.484 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.9 mm -71.27 73.49 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.034 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -120.92 132.05 54.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.908 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.35 -38.11 74.75 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.742 0.306 . . . . 0.0 110.764 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.86 77.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.261 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -64.77 112.27 4.87 Favored Glycine 0 C--N 1.334 0.467 0 CA-C-N 115.892 -0.595 . . . . 0.0 113.77 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 86.0 p -77.4 76.5 3.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.759 0.314 . . . . 0.0 110.735 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -108.29 -56.18 2.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.273 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.65 -124.6 0.17 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.455 ' OD2' HD13 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -111.31 -60.0 1.9 Allowed 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.291 -0.255 . . . . 0.0 111.395 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -126.71 -68.19 0.82 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.572 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -66.52 -172.1 0.15 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.387 0.613 . . . . 0.0 112.473 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.98 145.99 44.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.034 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.445 ' HB3' ' HG3' ' A' ' 54' ' ' GLU . 1.5 t70 -101.46 -176.28 3.1 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.884 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.799 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 63.8 t-105 . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.416 0.447 . . . . 0.0 111.015 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.503 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 66.03 156.29 0.1 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.843 0.354 . . . . 0.0 111.064 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.536 ' HB3' HG23 ' A' ' 9' ' ' VAL . 7.8 tt0 -107.03 109.17 20.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.348 0.594 . . . . 0.0 111.45 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.527 ' NE ' ' H73' ' C' ' 178' ' ' ' DT' . 5.7 ttm180 -78.54 104.82 9.39 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.787 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.86 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.3 pt -104.94 126.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -130.58 124.54 32.01 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 119.618 -0.833 . . . . 0.0 112.859 -177.608 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.884 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.94 103.95 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 173.973 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.839 HG22 ' HG3' ' A' ' 4' ' ' ARG . 15.9 p -66.24 93.06 0.2 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.921 0.391 . . . . 0.0 110.673 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' HB2' ' B' ' 114' ' ' TYR . 1.4 t -96.49 -135.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.596 -178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.539 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 5.4 t70 101.06 12.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 122.623 1.201 . . . . 0.0 108.615 -175.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.569 ' H ' HG12 ' B' ' 109' ' ' VAL . 44.8 m -159.65 -48.23 0.05 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.065 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.755 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -69.59 50.62 0.1 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.772 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 32' ' ' MET . 0.1 OUTLIER 57.9 3.05 0.2 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 177.625 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.936 ' HB2' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -59.08 -56.48 21.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 118.377 0.535 . . . . 0.0 111.817 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.567 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 28.6 mt-30 -48.84 -35.95 15.79 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.73 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -53.69 -43.88 69.28 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.418 0.554 . . . . 0.0 111.218 179.61 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.887 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.3 mt -65.47 -55.38 18.27 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.681 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -66.8 -25.49 66.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.96 179.778 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.476 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.36 -25.28 23.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.919 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.713 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.3 m-30 -88.12 -51.24 5.9 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.9 OUTLIER 132.53 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 O-C-N 125.069 1.481 . . . . 0.0 110.996 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.85 ' CG1' HD22 ' B' ' 117' ' ' LEU . 7.8 p -142.72 -39.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.658 ' O ' HD13 ' B' ' 117' ' ' LEU . 28.9 m-80 61.63 -120.96 0.75 Allowed 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.065 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.48 6.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -39.77 -63.92 0.54 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.13 0.491 . . . . 0.0 110.369 -178.253 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.55 -27.66 26.61 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.167 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -61.99 -62.22 1.94 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.44 0.296 . . . . 0.0 110.789 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.065 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -50.29 -59.27 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.783 178.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.716 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.5 p -50.39 -38.0 40.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.515 HG21 ' HA ' ' A' ' 43' ' ' ARG . 99.5 m -72.23 -55.6 6.95 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.464 HG22 HD21 ' A' ' 27' ' ' LEU . 54.5 m -56.52 -40.28 74.77 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.261 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.947 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -54.17 -56.12 21.27 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.731 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.467 ' OE1' ' HD3' ' A' ' 45' ' ' LYS . 12.6 tt0 -58.33 -37.68 75.61 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.07 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.468 ' O ' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -66.02 -29.01 69.29 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.883 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.658 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -65.35 -47.75 75.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.95 0.405 . . . . 0.0 110.273 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -72.76 -50.98 21.01 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.738 0.78 . . . . 0.0 110.386 178.565 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.635 ' HG3' ' HA ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -71.0 -17.21 62.65 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.078 -1.419 . . . . 0.0 113.78 -177.167 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.533 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -24.63 113.1 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.594 0.358 . . . . 0.0 111.451 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.439 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 0.8 OUTLIER 88.18 94.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.156 -178.874 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 69.93 129.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.158 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.635 ' HA ' ' HG3' ' B' ' 138' ' ' ARG . 1.6 mp0 -81.07 137.49 36.01 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.098 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.4 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.1 ttm180 172.83 -164.29 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.298 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 82.2 131.92 0.05 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.161 0.584 . . . . 0.0 112.066 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.58 139.25 38.41 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.926 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.453 ' O ' HG13 ' B' ' 146' ' ' VAL . 12.4 p 177.29 48.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.525 0.679 . . . . 0.0 110.527 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.444 ' HA ' ' CZ3' ' A' ' 44' ' ' TRP . 1.6 pm0 -70.87 59.8 0.23 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.954 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -145.17 106.53 4.21 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.964 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' GLN . . . . . 0.677 ' HG2' ' HA ' ' A' ' 44' ' ' TRP . 1.9 tp-100 -158.54 53.32 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.255 0.55 . . . . 0.0 110.661 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -85.21 112.22 20.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.277 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -164.3 131.1 2.34 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.555 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.2 mtt -124.96 139.97 53.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.907 0.384 . . . . 0.0 111.612 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.5 p -174.59 133.57 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.087 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.434 ' HB2' ' CE2' ' B' ' 172' ' ' TRP . 10.1 pt-20 -158.15 172.1 19.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.93 0.395 . . . . 0.0 111.746 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.433 HG23 ' HB2' ' B' ' 172' ' ' TRP . 11.2 t -109.21 -66.99 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.548 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.418 ' HB2' ' CE ' ' B' ' 170' ' ' LYS . . . 68.87 73.89 0.26 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.026 0.441 . . . . 0.0 111.783 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.27 -34.4 10.02 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.052 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -94.14 120.52 34.51 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.718 0.294 . . . . 0.0 110.623 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 6.6 pt -133.24 70.46 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.243 0.544 . . . . 0.0 111.816 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -113.46 160.39 18.5 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.599 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.2 tpp -75.47 60.87 1.22 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.868 0.366 . . . . 0.0 111.05 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -108.0 -70.44 0.8 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.135 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 37.75 -113.3 0.22 Allowed Glycine 0 C--N 1.342 0.914 0 CA-C-N 116.301 -0.408 . . . . 0.0 112.656 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 6.9 m 58.31 -148.23 0.48 Allowed 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' B' ' 166' ' ' ALA . 41.2 m-85 64.56 -80.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.421 0.288 . . . . 0.0 111.512 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' B' ' 165' ' ' PHE . . . 172.38 -71.84 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.116 0.484 . . . . 0.0 111.153 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.635 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . 28.7 t0 -60.78 -35.06 75.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.106 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.458 ' HB3' ' O ' ' B' ' 167' ' ' ASP . 4.1 tt0 71.44 -97.53 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.855 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 62.82 -170.26 0.18 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.767 0.318 . . . . 0.0 111.258 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.418 ' CE ' ' HB2' ' B' ' 156' ' ' ALA . 6.4 mtmm -137.93 -166.66 2.0 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.792 0.329 . . . . 0.0 111.534 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' B' ' 172' ' ' TRP . 12.0 p-10 -96.68 110.16 22.66 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.434 ' CE2' ' HB2' ' B' ' 154' ' ' GLU . 64.5 p-90 . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.228 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.742 " H3'" ' H72' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.44 0.673 0 C3'-C2'-C1' 105.923 2.302 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.742 ' H72' " H3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.732 0 OP1-P-O3' 111.013 1.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.58 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.41 1.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.651 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 107.136 -1.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.616 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 C4'-C3'-C2' 104.711 1.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.688 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C4'-C3'-C2' 104.338 1.138 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.646 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C3'-C2'-C1' 104.397 1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.646 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 N19-C1'-C2' 115.255 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.529 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 C3'-C2'-C1' 104.163 1.045 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.488 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.411 -0.671 0 C3'-C2'-C1' 105.354 1.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.488 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 N19-C1'-C2' 112.833 -0.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 106.907 0.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C1'-O4'-C4' 110.606 0.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.655 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.741 0 C4'-C3'-C2' 104.792 1.592 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.655 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O4'-C4'-C3' 106.189 0.589 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.669 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C4'-C3'-C2' 101.675 -1.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.669 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.759 0 O4'-C4'-C3' 104.503 -1.097 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.695 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C4'-C3'-C2' 104.814 1.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.695 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.526 0.802 0 C1'-O4'-C4' 107.235 -1.761 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.534 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C3'-C2'-C1' 104.308 1.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.534 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 C3'-C2'-C1' 104.992 1.637 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.484 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.738 0.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.478 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.944 0 C1'-O4'-C4' 107.035 -1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.42 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.427 1.234 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.406 ' C2 ' ' C2 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.923 0 C4'-C3'-C2' 104.213 1.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.47 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C1'-O4'-C4' 110.546 0.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 mmt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.397 0.141 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 1.5 mmtt 69.74 112.63 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 O-C-N 123.639 0.587 . . . . 0.0 110.918 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' B' ' 108' ' ' THR . 13.5 tp60 -95.36 121.56 37.15 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.023 ' HG3' HG22 ' B' ' 108' ' ' THR . 1.0 OUTLIER -77.68 102.95 7.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 121.499 0.666 . . . . 0.0 111.573 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.78 HD11 HG11 ' A' ' 28' ' ' VAL . 1.1 pt -100.79 111.57 30.88 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.567 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.54 120.48 38.87 Favored 'General case' 0 C--N 1.313 -1.02 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.846 -176.501 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.758 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.43 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.31 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.9 OUTLIER -68.06 79.94 0.22 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 -178.578 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.032 HG21 ' CD2' ' A' ' 14' ' ' TYR . 18.6 m -75.54 -145.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.701 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.94 -12.61 0.33 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.0 m -118.72 -62.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.09 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.875 ' HB2' ' CB ' ' B' ' 129' ' ' SER . 1.3 p30 -47.5 -91.84 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -175.87 41.19 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.423 -0.798 . . . . 0.0 111.342 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.088 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -79.16 -41.8 27.63 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.588 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.59 -46.33 39.2 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -176.718 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.874 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -47.92 -33.88 8.26 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.598 0.713 . . . . 0.0 112.304 179.547 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.978 HD13 HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -77.4 -60.48 2.35 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.705 179.577 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.588 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -59.41 -25.65 64.49 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.308 179.51 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HB3' ' HB2' ' A' ' 67' ' ' ASP . . . -59.12 -31.32 68.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.232 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.863 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -93.78 -27.95 16.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.565 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 27.5 t70 121.46 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.133 0.973 . . . . 0.0 110.812 176.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.978 HG13 HD13 ' A' ' 17' ' ' LEU . 8.5 p -150.25 77.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.565 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.966 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -73.54 51.98 0.37 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 0.0 111.935 -179.898 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.002 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 40.75 -2.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 118.479 2.77 . . . . 0.0 118.479 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.536 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 3.9 p -38.19 -62.96 0.52 Allowed 'General case' 0 C--O 1.24 0.587 0 CA-C-N 119.479 1.036 . . . . 0.0 110.378 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.424 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -85.64 -34.41 13.73 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.988 177.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.615 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -53.4 -61.34 2.36 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 120.825 0.345 . . . . 0.0 110.592 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.002 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -50.99 -68.24 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.473 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.635 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.4 m -50.09 -41.27 47.89 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 2.0 m -70.03 -51.63 30.6 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -56.12 -38.73 71.17 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.549 178.626 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.909 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.0 mtt -60.32 -56.17 24.68 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.82 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -48.85 -40.86 31.17 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.052 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -63.62 -57.06 11.27 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -10.09 59.21 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.093 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -87.0 -37.65 17.31 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -50.33 19.24 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.996 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.459 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -72.75 -17.98 61.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 113.948 -1.478 . . . . 0.0 111.876 -178.687 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.011 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.7 OUTLIER -13.98 120.71 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.513 1.125 . . . . 0.0 113.73 179.58 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.61 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -137.1 -66.16 0.52 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.62 ' HA ' ' CA ' ' B' ' 167' ' ' ASP . . . 92.1 120.07 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.984 0.514 . . . . 0.0 111.834 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.61 ' HB2' ' HB2' ' B' ' 169' ' ' ASN . 2.4 mt-10 -139.87 -71.52 0.38 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.577 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.576 ' HD3' ' O ' ' B' ' 171' ' ' ASP . 7.0 ptp180 176.52 107.01 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.701 0.286 . . . . 0.0 111.153 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' B' ' 168' ' ' GLU . 4.3 t90 -116.49 138.03 51.71 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 111.704 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 152.79 18.61 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.678 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.459 ' O ' ' CB ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -108.76 154.82 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.959 179.148 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.459 ' CB ' ' O ' ' A' ' 46' ' ' VAL . 3.6 tp10 90.88 152.82 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.306 0.643 . . . . 0.0 111.233 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -122.8 142.58 50.59 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.627 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.54 1.67 10.65 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -119.21 149.33 41.93 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.772 0.32 . . . . 0.0 111.03 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.568 ' O ' HG23 ' A' ' 53' ' ' VAL . . . -145.51 44.25 0.88 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.724 -0.751 . . . . 0.0 113.328 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.42 ' O ' ' NH2' ' B' ' 137' ' ' ARG . 3.2 mmt -63.8 116.9 6.2 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.895 0.378 . . . . 0.0 110.882 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 51' ' ' GLY . 2.7 t -130.3 43.3 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.69 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HA ' ' CB ' ' A' ' 72' ' ' TRP . 0.7 OUTLIER -152.66 147.75 26.49 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 111.4 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 55' ' ' VAL . 10.1 p -168.16 50.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.596 0.712 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.19 67.12 0.44 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.317 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -137.96 179.7 6.28 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.065 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -83.81 -75.99 0.31 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.913 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.8 pt 28.0 72.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.98 129.84 24.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.045 0.45 . . . . 0.0 110.976 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.464 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 1.4 mtp 173.45 -33.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.745 -179.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.466 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 1.1 t-20 77.09 -170.25 0.07 Allowed 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.133 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.449 ' O ' ' HB3' ' A' ' 64' ' ' SER . . . 106.02 59.52 0.62 Allowed Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.343 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 78.3 p 174.14 59.58 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.823 0.344 . . . . 0.0 110.493 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -166.08 52.76 0.09 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.929 0.395 . . . . 0.0 111.726 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.821 ' HB3' HD13 ' B' ' 139' ' ' LEU . . . -146.79 -59.74 0.29 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.027 0.441 . . . . 0.0 111.036 179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.786 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -87.02 -32.64 19.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.611 178.666 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -147.29 156.91 43.35 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.098 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -85.31 149.81 25.2 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 121.012 0.434 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HA ' ' CZ2' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -73.3 56.2 0.47 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.683 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -104.64 105.42 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.233 0.539 . . . . 0.0 111.04 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.498 ' CZ2' ' HA ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.775 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.477 ' CG ' ' H62' ' C' ' 173' ' ' ' DA' . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 CA-C-O 120.458 0.17 . . . . 0.0 111.429 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.546 ' HE2' " H3'" ' C' ' 175' ' ' ' DA' . 8.4 mttm -100.92 -171.25 1.97 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.675 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -105.97 100.34 9.9 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.459 0.647 . . . . 0.0 110.86 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.734 ' O ' " H3'" ' D' ' 191' ' ' ' DT' . 4.1 ttp180 -78.99 99.45 6.86 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.337 0.589 . . . . 0.0 110.632 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.088 HD13 ' CD1' ' A' ' 14' ' ' TYR . 21.8 pt -104.31 129.88 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.784 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 177.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.682 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.4 OUTLIER -131.35 125.83 33.68 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.428 -0.909 . . . . 0.0 112.84 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.763 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.8 98.29 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 108' ' ' THR . . . . . 1.023 HG22 ' HG3' ' A' ' 4' ' ' ARG . 68.1 p -66.87 95.79 0.39 Allowed 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.0 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.9 t -85.77 -128.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.915 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.599 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 24.0 t70 82.66 -12.56 0.89 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.923 0.783 . . . . 0.0 108.939 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -125.12 -61.44 1.29 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.01 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.804 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -44.4 -94.4 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.577 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.415 ' N ' ' HB3' ' A' ' 29' ' ' SER . 34.2 t 179.42 41.75 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.871 0.759 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.0 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.51 -45.32 13.72 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.649 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.5 mt-30 -48.89 -39.27 25.31 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -174.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.637 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -58.29 -52.62 64.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.239 0.927 . . . . 0.0 111.752 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.909 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -49.07 -49.97 38.97 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.432 0.634 . . . . 0.0 111.422 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.649 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 2.1 pttt -76.01 -29.25 58.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.474 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' B' ' 116' ' ' LEU . . . -64.12 -28.18 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.083 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.011 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.72 -42.75 12.41 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 118.819 -0.61 . . . . 0.0 109.699 178.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.63 ' CB ' ' HB3' ' B' ' 166' ' ' ALA . 0.2 OUTLIER 155.89 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 176.882 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.702 HG22 ' HB2' ' B' ' 164' ' ' SER . 76.0 t -154.19 91.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 121.816 -0.552 . . . . 0.0 111.777 -177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.571 ' HB2' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -57.51 -88.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 178.349 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.008 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -154.72 -0.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 115.864 1.801 . . . . 0.0 115.864 179.039 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 22.0 p -39.46 -63.16 0.59 Allowed 'General case' 0 C--O 1.241 0.62 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.563 -179.111 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.82 -30.11 24.5 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 121.293 -0.48 . . . . 0.0 112.214 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.676 ' HB3' HG22 ' B' ' 124' ' ' ILE . 5.8 tp -58.59 -61.03 2.9 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.776 0.288 . . . . 0.0 110.33 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.008 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.5 t -51.37 -64.63 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.012 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.875 ' CB ' ' HB2' ' A' ' 12' ' ' ASP . 7.8 p -48.41 -45.0 35.53 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -46.63 51.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 25.4 m -60.64 -37.9 83.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.917 178.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.85 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.79 -58.4 8.74 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.978 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -58.79 -36.06 73.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.888 -178.875 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -74.07 -49.51 23.73 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.529 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.756 ' HG3' HD21 ' A' ' 17' ' ' LEU . 21.6 tp10 -69.95 -20.24 63.34 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.874 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.36 -52.78 5.01 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 13.8 mtt180 -57.28 -56.62 19.5 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 121.503 0.668 . . . . 0.0 110.2 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.97 ' HD2' ' HB2' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -72.57 -35.82 68.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.623 179.697 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.831 HD21 ' CG ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 41.87 70.01 0.31 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.963 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.554 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 19.6 tpp180 119.71 78.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.152 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.97 ' HB2' ' HD2' ' B' ' 138' ' ' ARG . . . -157.44 160.09 37.98 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.683 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -69.05 0.77 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.534 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.27 128.86 20.27 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.765 0.317 . . . . 0.0 111.058 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 7.9 t-105 -162.42 151.4 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.246 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -128.97 -88.99 0.52 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 15.1 t 60.96 65.01 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.241 0.543 . . . . 0.0 111.435 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -93.04 -26.99 17.25 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.643 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 78.94 179.47 0.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.916 0.388 . . . . 0.0 111.41 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -105.6 116.19 31.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.84 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.98 -57.28 3.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.251 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -177.62 -138.82 3.14 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.768 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.44 161.36 17.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.692 0.282 . . . . 0.0 111.13 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.678 HG22 HG23 ' B' ' 155' ' ' VAL . 7.9 p -69.94 125.61 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.084 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -87.61 -63.23 1.34 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.434 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.678 HG23 HG22 ' B' ' 153' ' ' VAL . 46.2 t 77.18 92.53 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.01 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.23 135.73 9.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.992 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 153.84 29.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.1 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.455 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 1.7 t80 -140.9 162.46 35.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.363 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.455 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 5.3 mt 76.94 135.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.299 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.63 -27.81 18.81 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.535 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -52.95 57.09 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.684 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -177.45 -60.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 163' ' ' GLY . . . . . 0.547 ' HA3' ' CZ ' ' B' ' 165' ' ' PHE . . . 119.49 107.63 2.23 Favored Glycine 0 C--N 1.336 0.579 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.631 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.702 ' HB2' HG22 ' B' ' 122' ' ' VAL . 18.7 p -90.08 68.34 7.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.027 0.441 . . . . 0.0 111.551 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.547 ' CZ ' ' HA3' ' B' ' 163' ' ' GLY . 0.2 OUTLIER -123.04 62.84 1.0 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.089 0.471 . . . . 0.0 110.762 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.63 ' HB3' ' CB ' ' B' ' 121' ' ' ASP . . . -136.42 44.36 2.41 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.153 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.62 ' CA ' ' HA ' ' A' ' 41' ' ' ALA . 23.0 t0 -171.82 -74.83 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.905 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.624 ' HB3' ' CD1' ' A' ' 44' ' ' TRP . 0.3 OUTLIER -56.82 156.77 6.19 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.102 0.477 . . . . 0.0 111.595 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.61 ' HB2' ' HB2' ' A' ' 42' ' ' GLU . 55.9 t-20 -135.52 143.5 45.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.195 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.417 ' NZ ' ' OD2' ' B' ' 171' ' ' ASP . 6.2 tptp -169.71 -46.06 0.02 OUTLIER 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.738 ' HB3' ' CE3' ' B' ' 172' ' ' TRP . 0.3 OUTLIER -158.01 -90.26 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.738 ' CE3' ' HB3' ' B' ' 171' ' ' ASP . 44.6 p90 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.241 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.728 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 105.751 2.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.759 H2'' " O5'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.784 0 C3'-C2'-C1' 106.319 2.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.759 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.522 0 O4'-C1'-C2' 107.161 0.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.581 ' H71' " H2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C4'-C3' 106.413 0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.605 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C4'-C3'-C2' 104.652 1.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.61 ' H71' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C4'-C3'-C2' 104.648 1.448 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.661 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 104.621 1.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.486 H2'' ' C8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 O4'-C1'-C2' 104.842 -1.144 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.798 " H3'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C3'-C2'-C1' 104.566 1.333 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.722 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.765 0 C3'-C2'-C1' 105.442 1.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.722 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 O4'-C1'-C2' 107.126 0.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.592 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 N19-C1'-C2' 115.338 0.711 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 O4'-C1'-C2' 106.974 0.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.798 ' OP3' " H3'" ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-C2' 107.382 1.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.778 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C4'-C3'-C2' 102.387 -0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.778 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 O4'-C4'-C3' 106.164 0.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.501 ' OP1' ' HG3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 O4'-C1'-C2' 106.645 0.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.536 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.008 0 C1'-O4'-C4' 107.088 -1.866 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.734 " H3'" ' O ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.226 1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.648 ' H62' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C3'-C2'-C1' 106.008 2.363 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.537 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 104.289 1.135 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.425 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-C2' 107.261 1.056 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.42 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C1'-O4'-C4' 107.117 -1.845 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.494 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.631 0 C1'-O4'-C4' 110.757 0.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.494 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 104.011 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 102.063 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.531 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 1' ' ' MET . 5.9 mmtm 74.22 120.24 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.931 0.492 . . . . 0.0 110.872 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' B' ' 109' ' ' VAL . 1.7 tt0 -109.83 108.82 19.27 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.028 0.442 . . . . 0.0 110.235 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.803 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.1 ttm105 -79.63 110.15 14.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.969 . . . . 0.0 112.239 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.94 HD11 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -104.82 130.95 55.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 176.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.76 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -131.48 130.02 41.9 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.435 -1.306 . . . . 0.0 113.523 -177.213 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.898 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.51 98.21 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.619 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.501 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 1.2 p -71.08 67.42 0.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.581 0.705 . . . . 0.0 109.529 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 10' ' ' ASP . 7.1 p -88.83 -131.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-O 117.433 -1.27 . . . . 0.0 109.961 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 9' ' ' VAL . 32.3 t70 114.43 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 119.759 1.163 . . . . 0.0 110.975 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.475 ' H ' HG22 ' A' ' 9' ' ' VAL . 63.1 p 173.64 -27.29 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.524 -1.217 . . . . 0.0 113.379 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.741 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 33.0 m-20 -80.89 70.06 7.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.249 -0.981 . . . . 0.0 112.118 -177.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.542 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 34.5 m 57.46 -11.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 178.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.823 ' CE1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -56.84 -53.77 54.07 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.113 0.87 . . . . 0.0 109.868 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.2 mt-30 -49.35 -42.24 41.25 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.476 -178.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -53.63 -56.06 20.5 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.371 0.532 . . . . 0.0 111.843 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.787 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.06 -47.55 33.82 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.121 -179.18 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.782 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 22.8 pttt -79.42 -30.5 42.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.178 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -26.39 68.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.862 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.912 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.02 -43.94 11.35 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 118.636 -0.697 . . . . 0.0 109.481 178.418 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 154.49 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 176.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.449 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 74.4 t -157.93 90.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 CA-C-O 120.785 0.326 . . . . 0.0 110.642 -178.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.782 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -57.22 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.404 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.09 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -150.08 -2.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 179.866 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.618 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 55.6 p -39.61 -65.01 0.42 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.896 -177.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.605 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.66 -24.33 50.33 Favored Glycine 0 C--O 1.228 -0.25 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.603 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -64.24 -62.27 1.72 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 122.482 0.313 . . . . 0.0 111.324 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.09 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.5 t -53.18 -62.74 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 O-C-N 123.02 0.2 . . . . 0.0 110.815 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.807 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 12.9 p -48.35 -40.04 24.15 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -75.7 -45.82 34.68 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.416 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.66 ' HB ' HD21 ' B' ' 127' ' ' LEU . 1.9 p -57.84 -45.01 86.86 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 178.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.131 ' HA ' HD12 ' B' ' 117' ' ' LEU . 4.0 mmt -57.5 -57.19 13.77 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.151 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.428 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.0 OUTLIER -57.91 -39.83 78.89 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -63.65 -57.27 10.59 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.843 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.65 ' OE1' HD11 ' B' ' 117' ' ' LEU . 5.8 mt-10 -70.97 -14.49 62.38 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.825 178.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.812 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.22 -28.85 22.13 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 120.998 0.428 . . . . 0.0 110.822 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -49.84 10.9 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.974 0.893 . . . . 0.0 109.277 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.22 -42.28 31.8 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 113.884 -1.507 . . . . 0.0 112.554 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.07 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 32.1 52.25 0.24 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.385 0.674 . . . . 0.0 112.483 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 1.5 mmt180 178.54 35.24 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.99 0.424 . . . . 0.0 111.733 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -118.14 42.0 2.79 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.906 0.384 . . . . 0.0 111.257 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' HG2' ' HD3' ' A' ' 43' ' ' ARG . 6.1 pm0 -66.04 57.92 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.229 0.538 . . . . 0.0 111.697 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.49 ' HD3' ' HG2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 176.99 117.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.732 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.2 -83.36 0.13 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.138 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.758 ' HA ' ' HE2' ' B' ' 145' ' ' LYS . 9.7 ptpt -163.08 159.85 23.69 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.985 0.422 . . . . 0.0 111.926 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.4 m -132.68 54.46 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.281 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.94 81.37 0.21 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.685 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -106.39 -168.87 1.48 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.354 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -84.36 -58.54 2.71 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 72.08 116.62 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.144 0.497 . . . . 0.0 111.493 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -179.13 156.33 18.26 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.86 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.9 mtt 64.23 29.53 13.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.68 0.276 . . . . 0.0 111.56 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m -125.37 76.77 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 120.953 0.406 . . . . 0.0 111.071 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 53' ' ' VAL . 1.7 mp0 67.48 -71.17 0.11 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.228 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.555 ' HA ' ' CD1' ' A' ' 72' ' ' TRP . 3.1 t 45.37 45.41 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 112.018 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -47.2 -57.74 4.83 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.747 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.541 ' O ' ' CB ' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -143.93 161.19 39.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.191 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 57' ' ' ARG . 76.3 t80 147.55 -52.31 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.935 0.494 . . . . 0.0 111.332 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 pt -67.59 67.57 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -148.24 159.01 44.41 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.152 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 75.6 mtp -79.49 72.6 6.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.903 0.382 . . . . 0.0 111.267 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.45 129.15 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.231 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.515 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -92.02 160.79 26.36 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.938 -0.648 . . . . 0.0 113.042 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 3.8 m 73.86 145.52 0.08 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.121 0.486 . . . . 0.0 111.857 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -156.25 146.7 21.64 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.637 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -171.85 -120.78 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.072 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.16 131.97 55.22 Favored 'General case' 0 C--N 1.331 -0.231 0 O-C-N 122.274 -0.266 . . . . 0.0 110.549 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -150.35 -69.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 6.2 p-10 -117.57 -73.91 0.63 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.711 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER 158.29 -39.68 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.123 0.569 . . . . 0.0 111.467 179.016 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.424 ' HB3' ' CD1' ' A' ' 72' ' ' TRP . 71.0 m-20 63.6 -80.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.535 0.522 . . . . 0.0 111.693 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.555 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 3.8 p-90 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.91 -0.567 . . . . 0.0 110.678 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.436 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 119.71 -0.185 . . . . 0.0 111.149 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.01 119.28 28.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.202 0.525 . . . . 0.0 111.613 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.723 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.8 OUTLIER -111.04 108.29 17.97 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.526 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.858 ' NH2' HG21 ' B' ' 106' ' ' THR . 5.0 ttp180 -77.44 104.67 8.1 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.474 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.018 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -95.61 109.17 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.668 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.858 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -117.95 116.94 27.94 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 118.759 -1.176 . . . . 0.0 113.158 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.94 HG13 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -100.73 103.18 14.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.803 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 17.9 p -70.33 87.3 0.61 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.777 0.799 . . . . 0.0 110.249 -178.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.334 HG21 ' CD1' ' B' ' 114' ' ' TYR . 19.7 m -72.78 -137.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.912 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.671 ' N ' HG23 ' B' ' 109' ' ' VAL . 26.9 t0 92.3 -8.43 0.2 Allowed 'General case' 0 C--N 1.356 0.864 0 CA-C-O 121.458 0.646 . . . . 0.0 109.603 -177.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 6.1 t -136.47 -55.24 0.74 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.489 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.807 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -44.04 -94.25 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -177.625 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 32' ' ' MET . 0.1 OUTLIER 176.48 37.56 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.963 0.802 . . . . 0.0 110.939 -179.508 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.334 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.22 -43.97 15.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -179.293 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.732 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.2 mm100 -47.55 -37.46 12.3 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -174.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.812 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -64.32 -56.96 10.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.053 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 1.131 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -52.33 -41.42 62.98 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.255 -177.142 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.3 OUTLIER -79.38 -29.37 42.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.627 -179.846 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -64.38 -30.63 71.67 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.39 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.07 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.95 -40.47 13.02 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.499 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 22.2 t70 170.2 15.01 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.933 ' HB ' HD22 ' B' ' 117' ' ' LEU . 51.4 t -135.45 76.15 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 121.333 -0.854 . . . . 0.0 113.101 -177.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.115 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m120 -66.06 57.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.115 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.2 OUTLIER 50.99 -26.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.96 -64.22 0.42 Allowed 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.395 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.632 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.37 -20.77 53.92 Favored Glycine 0 C--O 1.227 -0.332 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.415 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.802 ' HG ' HD13 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.39 -60.35 4.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.998 HG23 HG22 ' B' ' 124' ' ' ILE . 74.8 t -54.1 -65.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.719 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.741 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 52.5 p -49.17 -46.95 46.14 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -75.41 -50.33 16.21 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 119.376 0.989 . . . . 0.0 110.358 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.662 ' HB ' HD22 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.12 -44.14 74.73 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.435 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.894 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.7 mmt -52.35 -45.66 65.78 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.203 178.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.542 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -52.93 -48.0 67.63 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.904 0.383 . . . . 0.0 111.535 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.7 -51.59 67.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.528 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 1.3 mm-40 -77.4 -9.29 58.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.977 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -88.05 -33.97 18.13 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -55.67 5.45 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 121.782 0.801 . . . . 0.0 109.354 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.517 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 4.6 mmp_? -84.56 -38.07 20.43 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.457 -178.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.912 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 43.97 60.79 2.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.033 0.533 . . . . 0.0 111.354 -177.878 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -163.85 5.29 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' B' ' 140' ' ' ARG . . . 74.69 81.08 0.11 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.798 0.439 . . . . 0.0 111.713 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.443 ' HG3' ' HG3' ' B' ' 138' ' ' ARG . 1.9 mm-40 -90.64 155.0 19.17 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.3 mtm105 177.98 -174.03 0.14 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.615 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 124.07 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 177.96 -69.8 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.841 178.363 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 19.5 t 48.02 55.23 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 121.596 0.712 . . . . 0.0 110.168 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.495 ' HB2' ' HD3' ' B' ' 145' ' ' LYS . 3.7 tt0 -108.42 -152.72 0.49 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.576 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -144.24 126.46 15.65 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.834 0.349 . . . . 0.0 110.788 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -166.61 130.54 2.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.947 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.22 -61.26 1.41 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 130.48 101.52 0.92 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.518 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpt -109.19 -19.88 13.17 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.64 -73.21 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.79 138.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.624 0.578 . . . . 0.0 111.852 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.8 t -147.39 46.82 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.128 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.87 112.93 17.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -51.29 2.88 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.251 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -110.99 76.81 1.0 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.632 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 8.7 pt 44.11 39.15 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -83.65 79.6 9.39 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.347 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -166.49 -39.26 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 162' ' ' ASN . . . . . 0.415 ' ND2' ' HA3' ' B' ' 126' ' ' GLY . 1.4 t30 70.27 -171.91 0.17 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.674 0.273 . . . . 0.0 110.943 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -128.24 92.58 0.35 Allowed Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.785 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.711 ' HB3' ' HB3' ' B' ' 168' ' ' GLU . 2.5 p -100.48 142.67 31.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.795 0.331 . . . . 0.0 111.657 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -100.16 -49.38 4.3 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -109.6 -56.17 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.03 0.443 . . . . 0.0 111.121 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' B' ' 164' ' ' SER . 5.1 m-20 -133.39 -99.42 0.27 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.944 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.711 ' HB3' ' HB3' ' B' ' 164' ' ' SER . 0.8 OUTLIER 61.71 -69.4 0.05 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.472 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 167' ' ' ASP . 0.0 OUTLIER -166.39 156.69 12.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.703 0.287 . . . . 0.0 110.851 -179.736 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' B' ' 170' ' ' LYS . 3.0 tptp -102.07 176.59 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.245 0.545 . . . . 0.0 112.077 -178.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.496 ' O ' ' HB3' ' B' ' 172' ' ' TRP . 0.7 OUTLIER -69.9 100.33 1.55 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.641 -179.532 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.496 ' HB3' ' O ' ' B' ' 171' ' ' ASP . 22.7 t90 . . . . . 0 C--O 1.252 1.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.629 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.854 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.44 0.694 0 O4'-C1'-C2' 107.163 0.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.854 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.639 0 P-O3'-C3' 120.82 0.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.598 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.574 0 C1'-O4'-C4' 110.653 0.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.418 ' C4 ' ' C5 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.889 0 C4'-C3'-C2' 104.761 1.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.651 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.89 0 C4'-C3'-C2' 104.71 1.51 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.651 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.781 0 C4'-C3'-C2' 104.559 1.359 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.692 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 O4'-C1'-C2' 107.087 0.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.485 H2'' ' C8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C4'-C3'-C2' 104.442 1.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.485 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 O4'-C1'-C2' 106.9 0.727 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.49 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.732 0 C3'-C2'-C1' 105.534 2.024 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.588 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-C2' 107.054 0.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.588 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 105.158 -0.856 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C1'-O4'-C4' 110.264 0.403 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.778 ' OP3' " H3'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.58 0 O4'-C1'-C2' 107.031 0.847 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.778 " H3'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C4'-C3'-C2' 102.606 -0.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.478 ' OP2' ' HG3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 106.844 0.676 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.706 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C4'-C3'-C2' 102.289 -0.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.706 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.963 0 C3'-C2'-C1' 104.827 1.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.583 ' H73' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-C2' 107.374 1.159 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.482 ' N6 ' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.855 1.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.516 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.41 -0.788 0 C3'-C2'-C1' 105.384 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.493 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.557 0 C3'-C2'-C1' 104.324 1.16 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.451 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 C1'-O4'-C4' 107.372 -1.663 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.41 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C1'-O4'-C4' 111.101 1.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.819 0 C4'-C3'-C2' 104.592 1.392 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 O4'-C1'-C2' 107.255 1.05 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 120.225 0.059 . . . . 0.0 111.124 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.34 144.58 17.21 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.658 0.266 . . . . 0.0 110.945 179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.781 ' HB3' ' CB ' ' B' ' 110' ' ' ASP . 1.4 tp60 -114.55 129.11 56.64 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.762 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.89 ' NH2' HG21 ' A' ' 6' ' ' THR . 15.1 ttp85 -78.31 99.41 6.31 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.714 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.804 HG21 ' CG ' ' B' ' 114' ' ' TYR . 1.3 pt -94.61 113.86 30.01 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.236 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.713 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.89 HG21 ' NH2' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -119.6 122.69 42.14 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.092 -1.043 . . . . 0.0 112.581 -178.013 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.93 HG12 HG22 ' B' ' 105' ' ' ILE . 2.1 p -99.23 106.75 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 114.242 -1.345 . . . . 0.0 107.936 177.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.799 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.7 OUTLIER -70.1 68.09 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.098 0.951 . . . . 0.0 108.6 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.832 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.8 p -72.54 -142.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.581 -1.645 . . . . 0.0 112.895 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.674 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 7.1 t70 86.61 -5.3 0.72 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.763 0.792 . . . . 0.0 109.311 -176.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.46 -73.03 0.66 Allowed 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.341 177.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.0 m-20 -32.94 -77.26 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.789 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.478 ' N ' ' HB2' ' B' ' 129' ' ' SER . 1.8 m 167.22 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.188 0.518 . . . . 0.0 111.106 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.913 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -84.6 -47.14 10.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 179.728 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.9 mt-30 -48.91 -38.94 24.23 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -174.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.68 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -52.07 -57.61 9.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.485 1.038 . . . . 0.0 111.574 179.17 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.003 ' CD1' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -55.4 -44.25 76.01 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.648 -177.782 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -76.28 -25.65 55.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.065 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -29.27 53.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.732 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.654 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.4 m-30 -87.71 -46.24 9.67 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 177.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 138.51 34.94 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.874 1.359 . . . . 0.0 111.223 177.832 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.844 HG21 HD21 ' B' ' 139' ' ' LEU . 16.4 t -116.01 76.59 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.014 0.435 . . . . 0.0 111.875 -178.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 16.2 p30 -67.84 44.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER 39.52 1.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 178.044 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' ASN . 6.9 p -38.57 -63.59 0.5 Allowed 'General case' 0 C--O 1.244 0.802 0 CA-C-N 119.048 0.84 . . . . 0.0 110.904 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.422 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -86.22 -21.37 52.36 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.613 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 1.003 HD12 ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -71.2 -62.54 1.36 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.896 0.348 . . . . 0.0 111.223 -179.376 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.028 HG21 HG22 ' B' ' 128' ' ' VAL . 2.1 t -51.05 -62.23 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.679 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 17.8 p -48.83 -31.12 6.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 122.651 0.38 . . . . 0.0 111.842 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -77.06 -57.92 3.57 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 m -52.96 -44.64 67.26 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.158 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.799 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 3.4 mmt -49.34 -43.55 43.86 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.411 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.569 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -63.61 -48.77 75.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.106 0.412 . . . . 0.0 110.44 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -60.82 -53.34 58.51 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.686 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -61.6 -41.8 97.95 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.269 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.783 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -58.46 -44.44 89.26 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.352 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.401 ' NH2' ' OE1' ' A' ' 33' ' ' GLN . 4.6 mtt-85 -69.5 -54.53 13.76 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 34' ' ' ASN . 3.8 mmp_? -57.41 -36.68 71.64 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.232 -178.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.033 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 8.39 85.18 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.195 0.998 . . . . 0.0 113.209 179.793 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.415 ' H ' ' HG2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -53.54 124.44 14.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.354 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.34 -70.44 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -178.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -158.2 77.76 0.8 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.881 0.372 . . . . 0.0 111.968 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.458 ' O ' ' HB3' ' A' ' 44' ' ' TRP . 4.1 ttt85 67.63 141.94 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.085 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.458 ' HB3' ' O ' ' A' ' 43' ' ' ARG . 52.4 t90 76.41 134.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.684 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.32 77.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.721 HG13 ' H ' ' A' ' 47' ' ' GLU . 1.5 p -157.27 -91.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.781 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.721 ' H ' HG13 ' A' ' 46' ' ' VAL . 0.8 OUTLIER 66.21 -62.28 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.752 0.251 . . . . 0.0 111.345 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -117.57 -176.18 2.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.884 0.373 . . . . 0.0 111.394 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.2 139.01 31.15 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.485 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -130.1 128.86 42.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.62 -104.79 0.26 Allowed Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.806 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.52 57.04 2.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.152 0.501 . . . . 0.0 111.495 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 53.0 t -141.9 109.42 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.846 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -127.53 132.91 49.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.964 0.412 . . . . 0.0 111.326 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.487 ' HB ' ' NE1' ' A' ' 72' ' ' TRP . 2.6 t -127.89 56.58 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.181 0.515 . . . . 0.0 110.843 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -132.22 149.03 52.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.404 ' HG3' ' N ' ' A' ' 58' ' ' PHE . 0.5 OUTLIER -81.53 -28.22 34.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.799 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.459 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 0.7 OUTLIER -173.82 -76.66 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.085 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' A' ' 58' ' ' PHE . 17.9 tt 169.82 148.84 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.566 0.346 . . . . 0.0 111.191 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.62 -160.99 1.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.892 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.402 ' O ' ' N ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -124.26 -92.22 0.53 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.3 t30 64.49 -55.51 0.27 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.796 0.438 . . . . 0.0 112.168 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 61' ' ' MET . . . 78.86 -56.45 4.27 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.47 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.416 ' CB ' ' HB3' ' A' ' 68' ' ' GLU . 12.6 m 67.21 -60.29 0.37 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.401 0.28 . . . . 0.0 111.547 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 62.29 48.6 4.7 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -175.55 -105.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.879 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.442 ' CB ' HD12 ' B' ' 139' ' ' LEU . 4.3 p-10 -83.13 48.55 1.39 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.506 0.67 . . . . 0.0 110.561 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.416 ' HB3' ' CB ' ' A' ' 64' ' ' SER . 1.0 OUTLIER 179.23 149.36 0.26 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.821 -179.62 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.427 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 9.7 t-20 -174.08 110.02 0.15 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.513 ' HD3' ' N ' ' A' ' 71' ' ' ASP . 8.7 tmtt? 75.44 152.71 0.13 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.086 0.469 . . . . 0.0 111.874 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.513 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 3.1 t70 -68.11 -160.14 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.556 179.11 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.487 ' NE1' ' HB ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.015 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.3 tmm? . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 120.655 0.264 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.647 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 15.4 mmtt -138.57 173.0 12.05 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.4 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.674 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 11.5 tp60 -125.97 124.64 41.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.083 0.468 . . . . 0.0 111.231 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.463 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.31 112.24 16.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.032 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.934 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -107.16 128.94 61.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.182 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.175 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.789 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.47 120.18 22.63 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.696 -179.804 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.67 HG23 HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -103.5 93.69 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 174.342 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.882 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.8 p -70.52 89.31 0.7 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.045 -1.034 . . . . 0.0 109.687 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 21.6 m -141.35 -0.98 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.781 ' CB ' ' HB3' ' A' ' 3' ' ' GLN . 0.0 OUTLIER 17.85 -74.65 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.645 1.111 . . . . 0.0 112.209 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.62 ' N ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -66.7 -20.16 65.91 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -179.143 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.696 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 1.2 t0 -78.72 62.8 3.33 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 120.017 1.28 . . . . 0.0 111.132 -178.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.569 ' HB3' ' CA ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER 58.91 -24.87 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 179.507 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.804 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.02 -56.52 3.29 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-O 121.708 0.766 . . . . 0.0 110.424 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.591 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 20.3 pt20 -49.54 -39.93 36.37 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.713 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.783 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -60.61 -43.84 97.0 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.664 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.799 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.45 -50.03 74.43 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.457 0.646 . . . . 0.0 111.439 -179.314 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.8 pttt -70.13 -25.88 63.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.581 178.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -60.38 -26.67 66.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.54 177.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.033 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -88.41 -44.94 10.38 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.372 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.691 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 150.13 63.0 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 176.852 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.735 ' CG1' HD23 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -157.6 -42.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.985 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.2 OUTLIER 58.18 59.26 3.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.465 0.65 . . . . 0.0 110.014 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.999 ' HB ' HG23 ' B' ' 128' ' ' VAL . 0.5 OUTLIER 40.53 -11.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 118.478 2.77 . . . . 0.0 118.478 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.736 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.03 -56.43 1.15 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.112 -177.888 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.76 -24.63 52.66 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.533 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.87 ' HB3' HG22 ' B' ' 124' ' ' ILE . 1.0 OUTLIER -70.32 -61.48 1.76 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.971 0.509 . . . . 0.0 111.142 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.028 HG22 HG21 ' A' ' 28' ' ' VAL . 71.0 t -46.42 -54.4 2.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.787 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.05 -40.73 86.01 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 90.6 m -74.05 -49.84 22.36 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.606 HG22 ' O ' ' B' ' 128' ' ' VAL . 3.4 t -55.34 -30.86 61.08 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.674 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.844 ' HE1' HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.69 -57.61 11.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.779 179.023 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -46.03 85.07 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -64.54 -50.59 66.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.812 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.593 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -71.84 -25.04 61.81 Favored 'General case' 0 C--O 1.217 -0.642 0 C-N-CA 120.349 -0.54 . . . . 0.0 110.069 178.267 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.68 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.56 -46.33 59.72 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 177.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -60.17 -56.02 26.66 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.505 0.669 . . . . 0.0 110.126 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.489 ' HD2' ' O ' ' B' ' 139' ' ' LEU . 4.6 tmm_? -77.81 -49.35 14.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.866 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.844 HD21 HG21 ' A' ' 22' ' ' VAL . 0.3 OUTLIER 37.27 -146.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.525 0.73 . . . . 0.0 111.924 -178.46 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 21.0 tpp85 -146.49 -84.63 0.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.778 -0.576 . . . . 0.0 111.942 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -179.51 97.08 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.652 0.263 . . . . 0.0 111.333 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -112.92 -45.2 3.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.058 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 77.49 169.88 0.22 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.177 0.513 . . . . 0.0 111.949 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 72.59 65.71 0.12 Allowed 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.35 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 20' ' ' TYR . 2.0 mmtm -134.54 95.14 3.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.159 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.82 52.41 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.251 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.22 -50.2 1.79 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.539 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 148' ' ' ASN . . . . . 0.403 ' O ' ' CB ' ' B' ' 149' ' ' GLN . 24.0 m120 68.41 177.64 0.25 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.995 0.426 . . . . 0.0 111.975 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 149' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' B' ' 148' ' ' ASN . 0.6 OUTLIER 85.0 105.52 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.0 179.744 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 150' ' ' GLU . . . . . 0.507 ' CG ' ' HG ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -119.76 149.84 41.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.718 179.297 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -72.54 61.19 1.56 Allowed Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.495 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.88 66.42 5.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.155 0.502 . . . . 0.0 110.962 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 13.7 p -164.71 134.92 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.804 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.545 ' HB3' ' CH2' ' B' ' 172' ' ' TRP . 2.4 pp20? -143.46 169.15 18.22 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.851 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.654 HG12 ' HB3' ' B' ' 172' ' ' TRP . 12.3 p -150.69 38.35 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.304 0.573 . . . . 0.0 111.937 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.484 ' C ' ' HG2' ' B' ' 157' ' ' ARG . . . -82.73 99.78 9.85 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.128 -0.357 . . . . 0.0 110.77 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 157' ' ' ARG . . . . . 0.484 ' HG2' ' C ' ' B' ' 156' ' ' ALA . 39.8 mmt-85 -154.27 135.62 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.565 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.424 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 48.9 m-85 66.08 -53.44 0.4 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 178.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.609 HG21 ' O ' ' B' ' 162' ' ' ASN . 17.1 mt 83.38 156.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.745 0.418 . . . . 0.0 111.224 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.466 ' H ' ' HG3' ' B' ' 160' ' ' GLU . 0.5 OUTLIER -78.71 -51.67 9.49 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.82 -179.635 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -159.58 -44.11 0.05 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 162' ' ' ASN . . . . . 0.609 ' O ' HG21 ' B' ' 159' ' ' ILE . 13.8 m-80 -57.06 133.04 54.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.94 0.4 . . . . 0.0 111.584 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -104.85 142.18 15.44 Favored Glycine 0 C--N 1.334 0.425 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.865 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.516 ' CB ' ' HG3' ' B' ' 168' ' ' GLU . 0.2 OUTLIER -71.71 64.89 0.48 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.049 0.452 . . . . 0.0 111.552 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -94.81 -1.54 52.6 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.759 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -145.53 105.57 4.03 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.395 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.524 ' O ' ' CB ' ' B' ' 168' ' ' GLU . 19.3 t70 71.49 -56.93 0.62 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.752 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.524 ' CB ' ' O ' ' B' ' 167' ' ' ASP . 32.5 tt0 104.7 100.31 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.191 0.997 . . . . 0.0 110.853 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.83 176.35 9.65 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.268 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 51.93 1.66 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.21 127.43 31.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.654 ' HB3' HG12 ' B' ' 155' ' ' VAL . 47.6 m0 . . . . . 0 C--O 1.253 1.287 0 CA-C-O 118.568 -0.73 . . . . 0.0 110.925 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.599 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O4'-C1'-C2' 106.759 0.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.599 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C3'-C2'-C1' 101.219 -1.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.499 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.539 0 O4'-C1'-C2' 107.329 1.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.799 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.953 0 C4'-C3'-C2' 104.66 1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.84 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 C4'-C3'-C2' 104.866 1.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.84 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 C4'-C3'-C2' 104.761 1.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.631 ' H62' ' NH2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.492 0 C3'-C2'-C1' 105.469 1.978 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.618 ' H72' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 N19-C1'-C2' 115.401 0.75 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.578 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.442 1.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.501 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C3'-C2'-C1' 104.799 1.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.501 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.512 -0.676 0 C4'-C3'-C2' 104.082 0.882 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.445 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O4'-C1'-C2' 106.803 0.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 N19-C1'-C2' 115.061 0.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-C2' 105.339 -0.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.406 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 106.939 0.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.406 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C1'-O4'-C4' 110.422 0.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 O4'-C4'-C3' 106.143 0.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.511 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 104.262 1.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.69 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.895 0 N19-C1'-C2' 115.54 0.838 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.557 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 104.787 1.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.61 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.732 0 C3'-C2'-C1' 105.839 2.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.61 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C3'-C2'-C1' 104.601 1.358 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.416 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.87 0 C1'-O4'-C4' 107.145 -1.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 104.273 1.073 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.791 0 C4'-C3'-C2' 104.252 1.052 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.498 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C4'-C3' 106.129 0.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -81.54 -173.06 4.17 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.035 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.848 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -122.77 110.02 14.94 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.651 0.739 . . . . 0.0 111.528 -179.03 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.886 ' HG3' HG23 ' B' ' 108' ' ' THR . 3.2 ttm105 -83.64 113.96 21.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.246 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.035 HD11 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -104.51 130.6 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.03 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.811 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -126.79 126.01 42.68 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.806 -0.758 . . . . 0.0 112.735 -177.469 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 HG22 ' B' ' 105' ' ' ILE . 0.6 OUTLIER -100.51 109.09 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.627 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.561 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 15.2 p -70.67 68.31 0.39 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.683 0.754 . . . . 0.0 109.333 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.835 HG11 ' CB ' ' A' ' 14' ' ' TYR . 8.3 p -76.23 -143.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.253 -1.34 . . . . 0.0 111.795 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.72 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 7.2 t70 87.43 1.56 0.44 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-O 122.067 0.937 . . . . 0.0 109.86 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.5 m -129.24 -64.72 0.89 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.18 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.823 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 1.2 m-20 -42.37 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.998 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m 178.54 41.61 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.607 0.639 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.912 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.5 OUTLIER -82.83 -49.48 9.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -179.166 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 4.1 mm-40 -48.15 -36.55 13.69 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -173.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.99 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.8 -53.29 59.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.86 0.754 . . . . 0.0 112.183 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.894 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.97 -45.76 51.78 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.236 0.541 . . . . 0.0 111.553 -178.287 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -77.73 -25.73 49.48 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.852 178.619 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -62.04 -28.65 69.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.621 178.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.692 ' CZ ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.12 -41.93 12.7 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.587 178.386 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.669 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 154.23 14.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 176.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 70.3 t -152.66 92.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 121.794 -0.566 . . . . 0.0 112.086 -177.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.465 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 4.8 p30 -58.41 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.06 HD11 HD12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -146.29 -2.67 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 115.599 1.704 . . . . 0.0 115.599 178.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -39.29 -64.37 0.47 Allowed 'General case' 0 C--O 1.245 0.82 0 C-N-CA 119.922 -0.711 . . . . 0.0 109.346 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.62 -28.67 26.2 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.058 -0.591 . . . . 0.0 111.964 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.688 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.71 -61.12 2.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.597 0.359 . . . . 0.0 110.752 179.238 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.056 HG22 HG21 ' B' ' 124' ' ' ILE . 2.4 t -51.98 -63.72 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 5.4 p -49.15 -39.05 27.41 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.5 m -71.88 -58.42 3.48 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.2 m -53.92 -42.84 69.22 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.01 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.002 ' HE1' HG23 ' B' ' 124' ' ' ILE . 11.4 mmt -56.61 -57.3 12.98 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.855 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -38.84 65.34 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -53.5 24.97 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.349 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.794 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -67.84 -25.94 65.8 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.248 178.21 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.573 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.93 -43.7 64.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -50.62 72.83 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.939 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.9 OUTLIER -56.79 -57.21 13.44 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.221 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 11.09 -82.97 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.32 1.048 . . . . 0.0 113.377 179.502 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 1.9 tpt180 63.91 4.04 1.84 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.433 ' HB3' ' CD2' ' A' ' 39' ' ' LEU . . . -71.52 53.32 0.21 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.802 -0.561 . . . . 0.0 111.626 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' O ' ' HD2' ' A' ' 43' ' ' ARG . 10.1 pt-20 -83.17 8.4 13.28 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.098 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -137.04 177.77 7.6 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.024 0.44 . . . . 0.0 111.317 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -82.2 168.16 17.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.172 0.51 . . . . 0.0 112.002 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.89 127.19 30.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.498 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 33.2 t -83.29 -71.21 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -171.5 171.01 5.59 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.947 0.403 . . . . 0.0 111.428 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.26 114.28 1.42 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.71 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.15 136.92 53.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.192 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.442 ' HA ' ' CE1' ' B' ' 158' ' ' PHE . 17.9 tt0 70.87 135.31 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.205 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -178.75 115.35 0.49 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.568 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.4 mtt -146.53 54.41 1.12 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.351 0.596 . . . . 0.0 110.066 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.521 ' HB ' ' HG2' ' B' ' 154' ' ' GLU . 9.9 p -93.59 -19.99 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.284 -179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 pp20? -57.41 154.39 10.94 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.082 0.468 . . . . 0.0 111.6 -179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 m -129.23 43.51 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.701 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.512 ' O ' ' HB2' ' A' ' 57' ' ' ARG . . . -103.66 152.81 21.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.848 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER 78.24 165.43 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.626 0.37 . . . . 0.0 110.706 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 67.63 -57.36 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.765 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.648 HG23 ' H ' ' A' ' 60' ' ' GLU . 7.0 tt -92.17 -66.32 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 59' ' ' ILE . 0.3 OUTLIER 43.96 66.58 0.81 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.504 0.669 . . . . 0.0 111.511 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.426 ' O ' ' NE ' ' B' ' 143' ' ' ARG . 4.7 tpt -77.71 -58.76 3.09 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.55 -0.75 . . . . 0.0 112.324 -179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.77 166.42 21.78 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' B' ' 142' ' ' GLU . . . 175.35 131.39 1.43 Allowed Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.883 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 m -121.48 131.29 54.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 117.029 0.415 . . . . 0.0 111.559 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 50.9 -165.03 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.887 0.375 . . . . 0.0 111.347 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.621 ' HA ' ' HA ' ' B' ' 139' ' ' LEU . . . -81.38 -59.41 2.64 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.559 0.695 . . . . 0.0 110.094 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.566 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 9.9 p-10 -126.15 70.95 1.24 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.737 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -172.03 92.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.023 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.41 -174.12 3.95 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.87 162.33 16.49 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.076 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -89.31 -174.25 4.32 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.704 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.279 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 tpt . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 120.711 0.291 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt -142.57 143.76 32.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.363 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.72 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.2 tt0 -113.97 126.25 54.93 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.355 0.598 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.503 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.86 108.32 11.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.433 -178.551 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.06 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -101.59 109.22 25.32 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.962 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.192 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.732 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -116.91 114.97 24.6 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.468 -178.488 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 1.035 HG13 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.31 111.94 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.669 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.886 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -70.02 91.47 0.68 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -179.704 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.96 HG22 HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -96.28 -158.88 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 112.152 -178.228 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.848 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 13.3 t70 96.71 -5.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.23 -61.55 1.66 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 175.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -49.93 -90.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.692 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 33.3 t -179.68 40.25 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.168 0.895 . . . . 0.0 111.229 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.98 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 1.1 t80 -82.71 -50.13 9.04 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.3 OUTLIER -47.39 -38.41 13.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.581 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.573 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.05 -44.0 64.06 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.612 1.096 . . . . 0.0 112.349 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -68.07 -47.76 67.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.075 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.613 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 2.8 pttt -72.06 -29.88 64.58 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.552 0.692 . . . . 0.0 110.483 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.98 -28.75 67.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.463 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.72 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -88.46 -42.58 12.04 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.591 -0.719 . . . . 0.0 110.476 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.6 28.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 177.067 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.533 ' O ' HD23 ' B' ' 117' ' ' LEU . 68.7 t -160.65 96.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 122.209 -0.307 . . . . 0.0 111.726 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.613 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 2.5 m-20 -60.03 -102.75 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 178.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.056 HG21 HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -145.12 6.83 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 179.037 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.618 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 2.6 p -41.6 -64.25 0.6 Allowed 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.629 0.728 . . . . 0.0 109.687 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.91 -23.19 42.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.658 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.823 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.47 -57.27 11.83 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.719 0.259 . . . . 0.0 111.018 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.057 HG22 HG21 ' A' ' 24' ' ' ILE . 5.4 t -54.21 -62.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.823 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 14.8 p -50.42 -44.19 55.09 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 87.5 m -68.55 -57.34 5.92 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.465 HG22 ' O ' ' B' ' 128' ' ' VAL . 0.7 OUTLIER -54.0 -44.41 70.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.397 179.594 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.929 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.3 mtt -60.21 -58.02 10.31 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.438 178.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.433 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.0 OUTLIER -49.35 -44.56 44.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.4 -179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -64.1 -57.4 9.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.565 0.222 . . . . 0.0 110.778 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.445 ' HB2' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.4 -15.18 62.81 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.99 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.69 -29.1 20.13 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 123.234 0.613 . . . . 0.0 111.089 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.58 -48.68 10.7 Favored 'General case' 0 CA--C 1.504 -0.825 0 CA-C-O 121.909 0.861 . . . . 0.0 110.118 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -64.45 -28.45 69.68 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.771 -1.559 . . . . 0.0 114.298 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.942 HD11 ' O ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -50.14 144.86 6.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.491 1.042 . . . . 0.0 111.805 -178.659 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.69 -50.85 0.63 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.848 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.94 65.97 1.12 Allowed 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.796 0.331 . . . . 0.0 111.27 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -95.79 146.53 24.47 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -179.397 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.426 ' NE ' ' O ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -155.22 109.81 2.96 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.587 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 6.2 p90 -67.55 133.04 48.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.735 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -177.35 155.4 1.11 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.836 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 58.8 t -60.8 120.29 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.172 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -56.71 149.98 16.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.831 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -167.84 148.05 5.05 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.3 60.39 0.1 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.304 0.573 . . . . 0.0 111.097 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -127.46 71.74 1.36 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.66 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -137.97 158.56 24.76 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.881 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.43 ' CG ' HG23 ' A' ' 53' ' ' VAL . 0.0 OUTLIER 65.37 -171.07 0.19 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.759 0.314 . . . . 0.0 111.196 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 7.3 p -143.32 -33.91 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.521 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 2.2 pm0 -81.45 151.21 27.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.272 0.558 . . . . 0.0 111.874 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 2.6 m -144.72 85.04 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.862 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -138.8 164.37 29.78 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.83 152.38 24.94 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.077 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.501 ' CD2' HG12 ' B' ' 159' ' ' ILE . 0.8 OUTLIER -167.28 165.25 15.29 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.538 0.209 . . . . 0.0 111.421 -179.696 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.501 HG12 ' CD2' ' B' ' 158' ' ' PHE . 21.2 mm 44.91 61.87 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.307 0.575 . . . . 0.0 111.189 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.512 ' HG2' ' HA3' ' B' ' 163' ' ' GLY . 0.6 OUTLIER -114.27 -43.24 3.23 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.704 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.34 -66.93 0.28 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.81 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.15 68.07 0.76 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.373 0.606 . . . . 0.0 110.297 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 163' ' ' GLY . . . . . 0.512 ' HA3' ' HG2' ' B' ' 160' ' ' GLU . . . -159.01 71.59 0.24 Allowed Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.046 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 72.47 179.32 0.23 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.543 0.211 . . . . 0.0 110.655 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.414 ' HB3' HG22 ' B' ' 122' ' ' VAL . 5.4 t80 -125.0 -85.34 0.64 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 121.182 -0.207 . . . . 0.0 111.363 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -107.15 -108.37 0.31 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.421 ' HB2' ' CE1' ' B' ' 120' ' ' TYR . 26.7 t0 64.41 170.52 0.18 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.052 0.453 . . . . 0.0 111.776 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 63.32 179.13 0.15 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.211 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 1.7 p30 -119.13 -92.67 0.53 Allowed 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 177.35 77.04 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.95 -49.56 8.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.819 0.342 . . . . 0.0 110.378 178.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.417 179.235 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.705 H2'' " C5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.178 0 C5'-C4'-O4' 108.363 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.752 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.614 0.598 0 C4'-C3'-C2' 101.862 -1.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.752 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 C3'-C2'-C1' 104.799 1.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.561 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -1.034 0 C1'-O4'-C4' 108.003 -1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.618 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 C3'-C2'-C1' 104.382 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.61 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C4'-C3'-C2' 104.584 1.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.519 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.487 ' H72' ' C8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.711 0 O4'-C1'-C2' 104.797 -1.185 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.461 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 O4'-C1'-C2' 106.933 0.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.484 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.828 0 C1'-O4'-C4' 107.546 -1.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.484 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 N19-C1'-C2' 113.059 -0.713 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 102.04 -0.472 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C1'-O4'-C4' 110.404 0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.432 -0.485 0 O4'-C4'-C3' 104.593 -1.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.43 ' C6 ' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 O4'-C1'-C2' 107.225 1.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.49 H2'' ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-C2' 107.147 0.952 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.671 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O4'--C1' 1.411 -0.728 0 C4'-C3'-C2' 104.435 1.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.477 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.065 0 C3'-C2'-C1' 104.838 1.527 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.51 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 105.341 1.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.538 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 105.594 2.067 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.538 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C4'-C3'-C2' 104.273 1.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.845 0.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.016 0 C4'-C3'-C2' 104.56 1.36 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.4 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 C1'-O4'-C4' 110.888 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.4 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.845 0 C4'-C3'-C2' 104.268 1.068 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C1'-O4'-C4' 110.305 0.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.526 ' C ' ' HB3' ' B' ' 110' ' ' ASP . 6.9 tpp . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -120.16 101.76 8.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.065 0.46 . . . . 0.0 111.037 179.023 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.748 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -103.81 111.87 24.57 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.344 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.89 105.89 9.38 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.121 -178.749 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.669 HG12 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -103.94 120.98 54.91 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.993 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 175.895 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.738 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -124.76 124.15 41.52 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.894 -177.199 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.792 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.74 108.08 21.99 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.757 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 27.3 p -70.64 89.96 0.74 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.753 0.311 . . . . 0.0 110.997 -178.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.004 HG21 ' CB ' ' A' ' 14' ' ' TYR . 3.0 t -84.44 -133.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.928 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.551 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.7 t0 85.73 -9.93 0.75 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.166 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.456 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 1.3 t -135.21 -54.19 0.8 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.388 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.755 ' HB2' HG13 ' A' ' 9' ' ' VAL . 1.4 m-20 -47.39 -103.28 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -178.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.61 35.32 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.767 0.794 . . . . 0.0 111.05 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.004 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.0 -38.68 22.3 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.595 1.158 . . . . 0.0 112.608 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.63 -43.99 36.88 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -176.259 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.79 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -54.35 -44.07 71.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.316 0.962 . . . . 0.0 112.26 -179.41 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.013 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.2 OUTLIER -59.15 -52.38 65.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.622 0.725 . . . . 0.0 111.239 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -74.01 -29.37 61.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.752 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.4 -27.93 69.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.267 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.107 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.3 OUTLIER -88.41 -45.02 10.32 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 118.585 -0.722 . . . . 0.0 110.356 179.096 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.677 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 159.85 18.89 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.029 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.671 ' O ' HD12 ' A' ' 17' ' ' LEU . 65.3 t -157.87 98.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 CA-C-N 118.411 0.551 . . . . 0.0 112.017 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 31.1 m-80 -57.31 -96.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.032 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.71 5.87 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 178.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.52 ' HB2' " O3'" ' D' ' 189' ' ' ' DG' . 1.2 t -39.34 -64.58 0.45 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.399 -177.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.86 -25.87 28.38 Favored Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.433 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.705 HD12 ' CD1' ' A' ' 17' ' ' LEU . 6.6 tt -58.61 -61.65 2.44 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.992 0.425 . . . . 0.0 109.885 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.032 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.3 t -49.96 -62.8 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.965 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.861 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.897 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 95.4 p -49.45 -43.42 44.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.05 -47.91 40.65 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.254 -0.646 . . . . 0.0 109.254 179.68 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.612 HG21 HG21 ' B' ' 131' ' ' THR . 23.3 m -61.47 -34.59 75.72 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.6 OUTLIER -63.97 -56.86 12.04 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.79 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.51 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -50.23 -34.13 21.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.69 0.281 . . . . 0.0 110.752 179.504 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.4 m-20 -75.36 -50.29 16.4 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.168 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.724 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 mm-40 -67.76 -23.47 65.23 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.06 178.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.669 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.0 -50.12 24.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -56.1 10.42 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.295 178.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.12 -46.03 92.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.394 -178.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.781 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 32.65 67.37 0.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.206 0.527 . . . . 0.0 111.468 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.54 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 63.0 ttt-85 -124.03 -87.55 0.62 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.249 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.54 ' HB2' ' O ' ' A' ' 40' ' ' ARG . . . 168.82 157.34 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.812 0.339 . . . . 0.0 111.772 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.33 -148.71 0.27 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.78 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.434 ' HD3' ' O ' ' B' ' 152' ' ' MET . 0.0 OUTLIER -129.09 178.73 6.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 111.077 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.1 m0 -129.93 176.1 8.33 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.165 0.507 . . . . 0.0 112.151 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.456 ' NZ ' ' O ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -80.26 128.06 33.09 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.008 -179.894 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.5 m -79.08 101.09 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.977 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 33.14 48.89 0.17 Allowed 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 54.85 30.92 14.66 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -95.95 154.32 17.3 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 122.174 -0.329 . . . . 0.0 110.766 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.11 61.91 0.05 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.893 0.378 . . . . 0.0 111.245 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.03 -87.87 1.93 Allowed Glycine 0 C--N 1.334 0.447 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.137 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.65 -162.45 0.08 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 122.548 0.339 . . . . 0.0 111.666 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.48 -65.44 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-O 120.718 0.294 . . . . 0.0 111.061 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HB3' ' CE2' ' A' ' 72' ' ' TRP . 0.4 OUTLIER -157.11 -70.87 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.215 179.428 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.705 ' HA ' ' HB2' ' A' ' 72' ' ' TRP . 2.0 t 52.42 46.04 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.562 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 55' ' ' VAL . . . -18.14 125.68 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.366 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -75.46 143.96 42.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.258 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.402 ' HA ' ' OE1' ' B' ' 142' ' ' GLU . 22.6 p90 -58.91 128.02 35.11 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.113 0.482 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 2.9 tp -113.56 -19.18 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.24 97.75 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.916 0.389 . . . . 0.0 110.895 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -66.04 149.25 50.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.787 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 70.7 38.39 1.25 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.451 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -118.96 -147.76 8.22 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.622 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.7 m -176.49 -104.36 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.544 0.172 . . . . 0.0 110.667 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 54.59 91.01 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -47.4 -63.32 1.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.277 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -152.41 144.84 24.07 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.858 -1.064 . . . . 0.0 109.729 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -135.41 18.6 3.37 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.334 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.455 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 7.4 m-80 61.58 79.09 0.26 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.858 0.361 . . . . 0.0 110.989 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -144.5 147.14 32.89 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.213 -179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.433 ' O ' HG13 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -99.54 -65.61 0.95 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.334 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.705 ' HB2' ' HA ' ' A' ' 55' ' ' VAL . 26.9 t90 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.852 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 111.542 0.201 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.433 ' HD3' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -174.35 98.12 0.1 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.155 0.502 . . . . 0.0 110.911 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.551 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 27.2 tt0 -98.79 114.23 26.69 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.887 179.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.522 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.76 102.33 7.12 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.453 -178.164 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.742 HD11 HG11 ' B' ' 128' ' ' VAL . 1.1 pt -100.79 109.74 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.696 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.71 117.18 29.55 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -175.63 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.807 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -101.16 104.47 16.31 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 173.794 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.862 HG22 ' HG3' ' A' ' 4' ' ' ARG . 44.6 p -70.1 85.12 0.54 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.209 0.528 . . . . 0.0 110.774 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.6 t -82.3 -138.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.064 -178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 4.3 t70 86.03 -5.34 0.8 Allowed 'General case' 0 C--N 1.35 0.624 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.54 -63.13 1.1 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.508 -1.223 . . . . 0.0 107.919 177.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.897 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -47.25 -92.44 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -179.218 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 26.6 t -178.82 40.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 118.903 0.774 . . . . 0.0 111.435 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.872 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.9 -41.5 18.83 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.759 0.824 . . . . 0.0 112.529 179.709 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.647 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.75 -39.55 25.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -174.924 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.669 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.49 -50.72 72.83 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.413 1.006 . . . . 0.0 111.944 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.957 HD23 ' CE2' ' B' ' 120' ' ' TYR . 2.1 mt -53.8 -43.57 69.45 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.599 0.714 . . . . 0.0 111.767 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 7.8 pttt -79.19 -32.53 44.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.52 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.482 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -61.93 -26.5 68.22 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.573 -1.194 . . . . 0.0 110.166 178.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.957 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.09 -39.52 14.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.881 179.291 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.67 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 26.2 t0 138.14 49.95 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.729 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -159.96 -37.06 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.891 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' B' ' 122' ' ' VAL . 11.9 p30 55.61 -109.61 0.5 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.047 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -144.2 1.38 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.792 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 t -38.82 -64.28 0.45 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.871 -178.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -89.35 -26.88 24.4 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.769 177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.65 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -55.66 -61.84 2.09 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.227 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.047 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.7 t -54.37 -55.49 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.312 0.577 . . . . 0.0 110.044 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.709 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 29.1 t -47.14 -47.66 23.49 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.1 -47.07 12.04 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.657 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.612 HG21 HG21 ' A' ' 31' ' ' THR . 2.4 m -56.43 -48.27 77.33 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.695 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.867 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 5.5 mmt -51.62 -48.55 63.25 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.768 179.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -54.58 -36.38 64.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -48.31 46.06 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 1.013 ' HB3' HD21 ' A' ' 17' ' ' LEU . 5.4 tt0 -74.62 -21.7 59.32 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.943 0.402 . . . . 0.0 110.376 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -78.09 -32.98 50.91 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.282 0.633 . . . . 0.0 110.754 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.636 ' CB ' HG11 ' A' ' 55' ' ' VAL . 8.2 mtt85 -81.98 -51.97 7.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.592 0.71 . . . . 0.0 110.655 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER -73.95 -21.34 60.06 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -176.673 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.107 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -30.05 100.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.559 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.551 ' O ' ' HB2' ' B' ' 141' ' ' ALA . 0.0 OUTLIER 171.7 -80.89 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.33 179.091 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' B' ' 140' ' ' ARG . . . 164.49 -87.53 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.785 0.434 . . . . 0.0 111.035 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 58' ' ' PHE . 2.8 tt0 47.49 90.49 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -77.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.252 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 22.6 m95 47.32 -97.31 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -174.05 109.24 0.14 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.498 0.19 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.8 p -62.26 150.9 8.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.29 -142.01 0.33 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.074 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -137.5 143.54 41.75 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.826 0.346 . . . . 0.0 110.551 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -81.24 123.46 28.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.827 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.22 141.0 28.97 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.27 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -124.97 122.51 4.71 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.682 -178.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.434 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 26.7 mtp -114.41 163.14 15.74 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.701 0.286 . . . . 0.0 110.83 179.182 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.592 HG12 ' H ' ' B' ' 154' ' ' GLU . 3.1 t -120.48 167.82 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.91 0.386 . . . . 0.0 111.816 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.592 ' H ' HG12 ' B' ' 153' ' ' VAL . 2.3 mm-40 -106.83 -93.02 0.39 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.396 -178.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.48 HG23 ' CD1' ' B' ' 172' ' ' TRP . 0.0 OUTLIER -108.52 -52.63 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.199 -179.58 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.778 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . . . 41.53 42.73 2.05 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.443 178.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -163.6 109.87 1.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.86 -51.09 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.189 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.49 HG22 ' N ' ' B' ' 160' ' ' GLU . 3.9 mt -108.82 165.56 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.634 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 161' ' ' MET . 0.0 OUTLIER -90.23 -167.31 1.8 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.87 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 161' ' ' MET . . . . . 0.519 ' HB2' ' O ' ' B' ' 160' ' ' GLU . 0.4 OUTLIER 82.46 155.11 0.11 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.361 0.6 . . . . 0.0 111.878 179.886 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -72.19 104.26 3.59 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.19 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.76 38.74 3.03 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.683 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 53.5 p -169.92 78.47 0.1 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.662 0.268 . . . . 0.0 111.621 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -99.06 -74.78 0.58 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.706 0.289 . . . . 0.0 110.418 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -119.31 -54.95 2.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.345 0.593 . . . . 0.0 110.148 178.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.41 ' CB ' ' HE1' ' B' ' 120' ' ' TYR . 2.1 t0 -153.37 -168.36 2.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 65.79 -158.89 0.27 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.662 -179.602 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.483 ' HB2' ' O ' ' B' ' 168' ' ' GLU . 41.0 m-80 75.34 103.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 -179.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 8.0 tptp -70.33 63.53 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.93 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.82 -167.48 1.34 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.279 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.778 ' HB2' ' HB2' ' B' ' 156' ' ' ALA . 83.3 m95 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.021 -0.99 . . . . 0.0 111.814 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.439 ' C4 ' ' H71' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 O4'-C1'-C2' 106.737 0.579 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.797 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.561 0 C3'-C2'-C1' 100.172 -1.805 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.797 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.693 0 C3'-C2'-C1' 106.377 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.679 ' C6 ' " C2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C3'-C2'-C1' 101.558 -0.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.532 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.913 0 N19-C1'-C2' 116.17 1.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.712 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.958 0 C1'-O4'-C4' 107.424 -1.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.81 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.495 0 C3'-C2'-C1' 104.796 1.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.853 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 N19-C1'-C2' 115.559 0.85 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.853 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 107.316 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.654 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.991 0 C3'-C2'-C1' 105.145 1.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.654 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 N19-C1'-C2' 113.162 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.462 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 C3'-C2'-C1' 101.467 -0.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . 0.453 ' N7 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C1'-O4'-C4' 110.516 0.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.551 ' H71' " C2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.785 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 101.741 -0.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.892 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 101.605 -0.782 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.892 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.858 0 C4'-C3'-C2' 104.701 1.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.627 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.044 0 C1'-O4'-C4' 106.512 -2.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.627 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.747 0 O4'-C1'-C2' 107.424 1.203 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.558 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C3'-C2'-C1' 105.514 2.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.57 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.669 0 C3'-C2'-C1' 105.221 1.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.57 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 O4'-C1'-C2' 106.954 0.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.485 H2'' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.899 0 C4'-C3'-C2' 104.533 1.333 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.609 " O5'" ' H8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 C3'-C2'-C1' 104.997 1.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.532 ' C4 ' ' C6 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 N19-C1'-C2' 115.593 0.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.532 ' C6 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C4'-C3' 106.185 0.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.457 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 111.107 0.039 . . . . 0.0 111.107 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.669 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -20.9 117.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.769 0.668 . . . . 0.0 112.418 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' B' ' 108' ' ' THR . 59.9 tp60 -100.14 120.33 39.71 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.016 0.436 . . . . 0.0 110.869 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.0 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.3 ttm-85 -79.29 112.44 16.52 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -177.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.784 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -118.2 122.18 68.99 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 176.77 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.753 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -131.54 140.36 49.47 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 118.918 -1.113 . . . . 0.0 112.909 -178.168 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.75 HG23 ' HB ' ' A' ' 9' ' ' VAL . 2.0 m -100.83 107.99 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.65 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.7 OUTLIER -70.42 67.64 0.34 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.622 0.725 . . . . 0.0 109.596 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.75 ' HB ' HG23 ' A' ' 7' ' ' VAL . 7.9 p -95.88 -137.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.03 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER 166.15 -82.83 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -178.903 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.618 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -104.8 9.89 34.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.19 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.752 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -80.22 68.33 6.33 Favored 'General case' 0 C--N 1.359 0.98 0 CA-C-N 119.807 1.185 . . . . 0.0 108.706 179.416 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB3' ' N ' ' B' ' 133' ' ' GLN . 2.6 m 61.16 -28.59 0.05 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.682 -1.144 . . . . 0.0 113.736 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.724 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -45.91 -60.26 2.35 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.149 0.5 . . . . 0.0 111.115 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 5.1 pt20 -48.75 -38.26 21.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.938 -177.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.674 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.02 -46.56 87.88 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.43 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.771 HD21 ' CB ' ' B' ' 135' ' ' GLU . 0.5 OUTLIER -55.34 -49.69 71.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.474 0.654 . . . . 0.0 110.849 -179.724 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.678 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.3 pttt -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.538 179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.23 -29.39 67.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.337 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.968 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.3 -44.33 10.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.526 178.917 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.595 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . 0.4 OUTLIER 152.28 27.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.393 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.5 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 76.4 t -160.15 87.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.678 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -53.89 -87.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.576 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.007 HD13 HG23 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -155.22 -1.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 179.515 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.804 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.3 p -38.91 -64.51 0.44 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-N 118.941 0.791 . . . . 0.0 111.681 -176.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.58 -19.99 57.26 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.774 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.712 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -66.8 -61.66 1.84 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 122.766 0.426 . . . . 0.0 110.741 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.935 HG23 ' CG2' ' A' ' 24' ' ' ILE . 10.0 t -50.55 -60.4 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 C-N-CA 120.309 -0.556 . . . . 0.0 109.923 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.864 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 8.8 p -50.1 -41.78 48.98 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.8 m -67.1 -52.47 41.51 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.516 HG22 HD11 ' B' ' 127' ' ' LEU . 49.1 m -61.24 -34.6 75.4 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.836 178.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.931 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.88 -58.15 6.25 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.562 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.464 ' OE1' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.92 -33.99 19.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.718 0.294 . . . . 0.0 110.885 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.41 -50.73 12.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.831 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.78 ' CB ' HD21 ' B' ' 117' ' ' LEU . 1.4 mm-40 -70.83 -19.14 62.69 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.318 177.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.788 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.49 -49.11 8.93 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.664 0.786 . . . . 0.0 110.88 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.464 ' HD2' ' OE1' ' A' ' 33' ' ' GLN . 4.7 mtt85 -57.49 -53.7 55.18 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.389 0.614 . . . . 0.0 110.886 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -59.21 -45.44 91.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.869 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 24.54 94.26 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.42 144.97 33.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.359 0.599 . . . . 0.0 111.842 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.649 ' HB3' HG11 ' A' ' 46' ' ' VAL . . . -136.31 -80.36 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.097 178.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -69.3 -71.71 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.301 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp-105 -166.29 -52.17 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.759 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.47 -95.4 0.44 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -99.67 118.5 36.33 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.705 0.288 . . . . 0.0 111.242 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.701 HG13 ' H ' ' A' ' 47' ' ' GLU . 1.4 p -128.77 -77.66 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.546 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.701 ' H ' HG13 ' A' ' 46' ' ' VAL . 10.7 tt0 -136.32 135.54 38.97 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.842 0.354 . . . . 0.0 111.574 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -144.37 140.71 29.23 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -115.23 138.01 51.4 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.061 0.458 . . . . 0.0 111.985 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -109.24 132.9 53.68 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.156 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 119.98 -148.67 17.9 Favored Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.127 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.473 ' O ' HG13 ' A' ' 53' ' ' VAL . 0.0 OUTLIER 59.71 83.66 0.13 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.013 0.435 . . . . 0.0 111.736 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 52' ' ' MET . 0.3 OUTLIER -160.1 168.76 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -64.09 1.02 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.772 ' HA ' ' CE2' ' A' ' 72' ' ' TRP . 12.0 t 70.92 10.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.287 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 46.52 32.14 1.54 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.052 0.453 . . . . 0.0 111.652 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.439 ' HD3' ' HB ' ' A' ' 55' ' ' VAL . 23.9 ptt180 -109.47 -17.04 13.86 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.31 -47.05 5.58 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.59 0.233 . . . . 0.0 111.322 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.727 HD13 ' N ' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -137.53 153.63 28.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.284 -179.84 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.727 ' N ' HD13 ' A' ' 59' ' ' ILE . 3.3 pt-20 -117.19 114.57 23.85 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.126 0.489 . . . . 0.0 111.607 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.664 ' HG2' HD12 ' A' ' 59' ' ' ILE . 0.5 OUTLIER -171.12 123.46 0.59 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.9 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -73.32 -70.82 0.34 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.759 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 64' ' ' SER . . . 73.76 162.99 8.37 Favored Glycine 0 C--N 1.337 0.596 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.44 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 98.9 p 174.53 113.98 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.764 0.282 . . . . 0.0 111.522 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -101.72 -70.32 0.75 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.857 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.595 ' HB3' ' HB3' ' A' ' 21' ' ' ASP . . . -162.29 -118.95 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.444 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.473 ' O ' HG21 ' A' ' 22' ' ' VAL . 3.5 m-20 -84.54 80.83 9.1 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.058 0.456 . . . . 0.0 110.848 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -124.73 177.56 5.92 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.035 -179.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.21 136.97 40.2 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.863 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.11 116.65 17.3 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.848 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -93.04 -50.19 5.65 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.913 179.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.772 ' CE2' ' HA ' ' A' ' 55' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.493 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 120.509 0.195 . . . . 0.0 111.384 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.454 ' HD3' ' OP2' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -168.58 163.02 12.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.052 179.787 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.546 ' HG2' HG22 ' B' ' 105' ' ' ILE . 3.3 tt0 -109.93 110.57 21.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.132 0.492 . . . . 0.0 112.129 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.528 ' HD3' ' H71' ' C' ' 178' ' ' ' DT' . 7.8 ttm105 -78.69 102.38 8.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.777 HD11 HG11 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -99.09 116.09 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 178.891 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.753 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -115.74 124.5 50.96 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.599 -176.662 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 1.007 HG23 HD13 ' A' ' 24' ' ' ILE . 1.1 t -100.6 98.7 7.23 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 108' ' ' THR . . . . . 1.0 HG22 ' HG3' ' A' ' 4' ' ' ARG . 48.4 p -70.16 98.66 1.37 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.97 -0.456 . . . . 0.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.104 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.0 t -88.98 -129.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.449 ' N ' HG12 ' B' ' 109' ' ' VAL . 22.5 t70 85.47 -9.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 67.3 p -131.5 -61.33 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.824 178.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.881 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -39.27 -92.54 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 28.5 t 170.85 39.38 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.731 0.776 . . . . 0.0 110.149 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.104 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -84.23 -45.17 13.16 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.26 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.7 -34.92 12.87 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.305 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.788 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -60.71 -56.92 15.51 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.678 0.672 . . . . 0.0 111.549 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.931 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.9 mt -47.16 -48.85 23.36 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.069 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -77.04 -26.21 53.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.643 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.82 -30.4 71.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.699 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.887 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.16 -41.41 13.02 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.789 178.408 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.563 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 152.95 26.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.029 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.777 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.6 OUTLIER -135.29 80.1 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -179.001 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.03 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.69 53.74 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.652 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER 42.35 -9.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 118.701 2.852 . . . . 0.0 118.701 178.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.565 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.25 -63.15 0.51 Allowed 'General case' 0 C--O 1.244 0.773 0 CA-C-N 119.601 1.091 . . . . 0.0 110.946 -176.966 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.49 -26.78 34.72 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.693 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.59 ' CD1' ' CD1' ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.4 -61.51 2.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.628 0.371 . . . . 0.0 110.436 179.332 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.968 HG23 ' CG2' ' B' ' 124' ' ' ILE . 4.0 t -47.74 -64.31 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.752 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.05 -34.8 10.06 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 178.574 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 98.8 m -72.44 -52.8 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -42.55 99.14 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.424 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.728 ' HE2' ' CG2' ' A' ' 24' ' ' ILE . 6.7 mmt -52.31 -51.17 60.13 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.674 179.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.498 ' N ' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.92 -36.91 68.25 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.702 0.287 . . . . 0.0 111.079 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.4 -52.51 26.25 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.771 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.77 -19.21 62.73 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.61 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.708 ' O ' HD11 ' B' ' 139' ' ' LEU . . . -87.45 -28.82 21.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 122.776 0.43 . . . . 0.0 111.243 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -54.07 6.39 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 121.652 0.739 . . . . 0.0 109.871 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.562 ' HB3' ' HB2' ' B' ' 141' ' ' ALA . 3.9 mmp_? -83.42 -37.87 22.66 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.12 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.968 HD23 ' CD2' ' A' ' 20' ' ' TYR . 2.2 mp 48.23 -85.01 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.645 0.778 . . . . 0.0 112.1 -178.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.41 -59.39 2.55 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.456 0.169 . . . . 0.0 111.342 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' B' ' 138' ' ' ARG . . . 57.54 -159.75 0.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -123.34 163.8 20.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.955 0.407 . . . . 0.0 111.31 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.94 59.76 3.9 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -87.11 -40.91 14.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.144 -179.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -74.85 86.84 2.25 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 120.987 0.422 . . . . 0.0 111.821 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.465 HG12 ' HG2' ' B' ' 147' ' ' GLU . 25.8 t -81.29 134.73 26.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.465 ' HG2' HG12 ' B' ' 146' ' ' VAL . 2.0 mm-40 65.85 98.67 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.423 0.63 . . . . 0.0 111.612 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 148' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' B' ' 149' ' ' GLN . 16.3 t30 -102.76 -145.33 0.36 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.676 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 149' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' B' ' 148' ' ' ASN . 33.6 mt-30 73.12 -55.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.438 0.295 . . . . 0.0 111.379 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.41 130.59 44.35 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 110.716 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -115.91 9.61 18.57 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.871 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -116.83 86.44 2.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.339 0.569 . . . . 0.0 111.105 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.451 HG13 ' N ' ' B' ' 154' ' ' GLU . 8.9 p -117.04 -46.63 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.46 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.451 ' N ' HG13 ' B' ' 153' ' ' VAL . 1.0 OUTLIER -134.04 -58.31 0.85 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 111.136 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.577 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 16.4 t 76.45 3.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 176.33 150.95 0.14 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.892 0.377 . . . . 0.0 111.529 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 157' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' B' ' 157' ' ' ARG . 8.7 tpt180 -175.19 -50.87 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.618 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.401 ' HD1' ' HA ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -103.05 163.12 12.41 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.848 179.165 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.546 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 1.8 pp -35.72 142.56 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.37 -179.21 0.44 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.883 -179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.77 -65.07 0.5 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.481 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -103.44 -59.8 1.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.581 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 137.26 -87.18 0.23 Allowed Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.547 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.1 84.03 1.39 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -106.78 178.03 4.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -44.26 -63.6 0.85 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.01 0.433 . . . . 0.0 111.162 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.581 ' HB3' ' CE1' ' B' ' 120' ' ' TYR . 12.6 t70 -165.16 105.27 0.77 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.936 179.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.13 111.58 0.1 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.676 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -151.85 165.94 32.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.06 0.457 . . . . 0.0 111.879 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.546 ' NZ ' ' O ' ' B' ' 159' ' ' ILE . 2.6 pttt -87.96 152.84 21.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.945 178.684 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.84 145.15 56.34 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.603 0.24 . . . . 0.0 110.432 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.577 ' CE2' ' HA ' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.301 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.641 " H2'" ' H72' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C1'-O4'-C4' 110.624 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.641 ' H72' " H2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C1'-O4'-C4' 110.485 0.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 104.124 1.017 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.65 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.918 0 C4'-C3'-C2' 104.661 1.461 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.603 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C4'-C3'-C2' 104.729 1.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.603 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.411 -0.672 0 C4'-C3'-C2' 104.491 1.291 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.664 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.535 0 C3'-C2'-C1' 104.487 1.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.664 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.74 0 O4'-C1'-C2' 104.998 -1.002 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.498 " O5'" ' H8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 O4'-C1'-C2' 107.138 0.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.496 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.524 0.647 0 C3'-C2'-C1' 105.801 2.215 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.593 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C1'-C2' 106.848 0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.593 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 101.81 -0.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 106.908 0.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 107.027 0.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.524 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C4'-C3'-C2' 102.419 -0.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.524 ' C8 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C1'-O4'-C4' 110.393 0.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.899 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.698 0 C4'-C3'-C2' 101.343 -1.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.899 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C4'-C3'-C2' 104.26 1.06 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.658 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C5'-C4'-O4' 108.741 -0.412 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.56 " H2'" ' H71' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 104.928 1.592 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.56 ' H71' " H2'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.718 0 C4'-C3'-C2' 104.796 1.596 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.413 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-C2' 107.101 0.91 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.413 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C1'-O4'-C4' 107.045 -1.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.455 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 C4'-C3'-C2' 104.312 1.112 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 O4'-C1'-C2' 104.836 -1.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C1'-O4'-C4' 110.279 0.413 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -163.08 122.34 2.15 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.93 0.395 . . . . 0.0 110.981 179.098 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 36.7 tp60 -109.66 117.51 34.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.232 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.932 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.5 ttm180 -78.51 106.12 10.25 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 121.67 0.748 . . . . 0.0 112.221 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.969 HD13 ' CD1' ' B' ' 114' ' ' TYR . 7.0 pt -110.41 128.1 66.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 177.291 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.731 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.03 131.6 42.62 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 118.461 -1.295 . . . . 0.0 113.822 -177.497 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.95 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.48 105.39 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.453 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.604 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 7.4 p -70.55 91.68 0.8 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.281 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.022 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -88.58 -147.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.805 -178.908 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.589 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 28.4 t70 120.49 -0.28 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.327 1.051 . . . . 0.0 108.511 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.9 p -158.03 -33.12 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.079 -0.964 . . . . 0.0 112.694 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.743 ' HB2' HG13 ' A' ' 9' ' ' VAL . 2.3 m-20 -75.05 19.9 0.14 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -176.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.579 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 32.5 m 81.38 8.23 1.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 175.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.022 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -63.25 -45.77 90.01 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.504 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 7.4 mt-30 -49.62 -41.24 41.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -176.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.606 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -59.53 -48.46 81.56 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.006 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.4 OUTLIER -50.34 -56.91 9.3 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.525 0.679 . . . . 0.0 111.498 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.636 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 pttt -70.4 -25.83 63.41 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.113 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -65.71 -27.03 68.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.325 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.953 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.11 -38.69 15.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 118.316 -0.85 . . . . 0.0 110.264 178.893 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.3 m-20 148.98 33.84 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.0 t -151.08 88.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 121.821 -0.55 . . . . 0.0 112.429 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.037 ' O ' HD12 ' A' ' 24' ' ' ILE . 63.4 m-80 -70.04 60.82 0.18 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.3 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.037 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 40.65 -11.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 118.539 2.792 . . . . 0.0 118.539 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -38.1 -62.05 0.6 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.773 1.17 . . . . 0.0 110.787 -177.619 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.02 -30.97 40.59 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.231 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.537 ' HB3' HG22 ' A' ' 24' ' ' ILE . 2.8 tp -60.27 -61.68 2.42 Favored 'General case' 0 C--N 1.338 0.074 0 O-C-N 122.916 -0.167 . . . . 0.0 111.001 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.084 HG22 ' CG2' ' B' ' 128' ' ' VAL . 37.2 t -45.66 -66.31 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.063 0.459 . . . . 0.0 110.986 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 15.3 p -49.39 -44.08 44.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.408 ' O ' ' HG2' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -72.72 -44.85 61.19 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.177 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 m -54.42 -38.16 65.93 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.559 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.825 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 5.5 mmt -56.34 -57.38 12.52 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.58 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 30' ' ' THR . 4.5 pt20 -50.44 -38.63 44.45 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.74 0.305 . . . . 0.0 111.317 -179.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -69.88 -51.67 31.23 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.431 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.689 ' HB3' HD21 ' B' ' 117' ' ' LEU . 4.5 tp10 -68.72 -23.11 64.32 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.273 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.782 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -79.31 -46.02 18.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.572 0.349 . . . . 0.0 110.689 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.27 -50.8 68.71 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.913 0.863 . . . . 0.0 109.971 178.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.702 ' HD3' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -83.76 -49.93 8.62 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.392 -1.731 . . . . 0.0 113.486 -177.2 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.266 HD11 ' CE2' ' B' ' 120' ' ' TYR . 62.7 mt 48.58 93.18 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.467 0.707 . . . . 0.0 111.865 -178.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.583 ' HA ' ' O ' ' B' ' 168' ' ' GLU . 0.0 OUTLIER 81.9 -108.57 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.507 179.573 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.702 ' HB3' ' HD3' ' A' ' 38' ' ' ARG . . . 67.68 127.01 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.219 0.533 . . . . 0.0 112.01 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.01 80.96 8.99 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.533 ' HG3' ' HB2' ' B' ' 147' ' ' GLU . 0.0 OUTLIER -175.47 120.35 0.19 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.219 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -127.1 -156.14 0.73 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.91 -179.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.52 ' NZ ' ' O ' ' B' ' 153' ' ' VAL . 0.0 OUTLIER -76.15 166.85 22.87 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.519 0.676 . . . . 0.0 112.472 -179.036 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.9 p -167.45 127.58 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.485 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -107.67 103.02 12.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.058 0.456 . . . . 0.0 111.349 -179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -148.15 35.93 0.83 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.197 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -139.89 120.16 13.87 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 120.787 0.327 . . . . 0.0 111.612 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -93.53 152.79 18.82 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.701 179.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -167.4 -120.64 0.53 Allowed Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.795 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.2 ptp 179.42 -47.89 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.575 0.226 . . . . 0.0 111.541 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.745 HG23 ' CG2' ' A' ' 55' ' ' VAL . 3.0 m -109.32 160.69 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-O 120.793 0.33 . . . . 0.0 111.815 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 72' ' ' TRP . 67.8 mm-40 -53.05 -65.15 0.61 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.249 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.745 ' CG2' HG23 ' A' ' 53' ' ' VAL . 4.0 t 60.08 10.04 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.411 ' O ' ' HD2' ' B' ' 143' ' ' ARG . . . 41.63 41.16 1.6 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.158 0.504 . . . . 0.0 111.296 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -128.44 95.85 4.26 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.554 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -161.32 173.95 14.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.617 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.6 pt -109.58 -100.45 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.15 -165.01 0.2 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.554 0.216 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.0 ttp -100.04 41.82 1.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.649 0.261 . . . . 0.0 111.504 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.539 ' HB2' ' HB2' ' B' ' 145' ' ' LYS . 1.0 OUTLIER 69.84 -57.88 0.54 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.924 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.31 176.91 51.6 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.15 -0.547 . . . . 0.0 112.116 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -102.58 -89.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.548 0.174 . . . . 0.0 110.653 179.721 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.546 ' HB3' ' O ' ' A' ' 64' ' ' SER . 4.7 p90 172.18 171.47 0.11 Allowed 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.975 0.417 . . . . 0.0 111.098 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.78 -84.25 0.42 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.953 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -161.79 -75.91 0.05 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.205 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.79 -29.38 13.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.507 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -37.13 113.9 0.28 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.379 0.672 . . . . 0.0 112.493 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.9 110.98 0.17 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.118 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -139.45 -61.86 0.54 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.598 ' HB3' ' HB2' ' A' ' 54' ' ' GLU . 2.0 t90 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.112 -0.946 . . . . 0.0 110.995 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 120.212 0.053 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.581 ' HG3' ' C7 ' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -34.39 122.83 0.51 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 8' ' ' THR . 7.6 tt0 -100.34 113.28 25.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.591 178.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.5 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 4.5 ttm180 -78.38 101.11 7.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.218 0.532 . . . . 0.0 110.607 -179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.748 HG12 HG13 ' A' ' 7' ' ' VAL . 0.6 OUTLIER -99.36 118.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.41 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.731 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -123.22 123.21 40.26 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.152 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.78 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.45 103.33 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 175.511 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.932 HG22 ' HG3' ' A' ' 4' ' ' ARG . 64.9 p -70.06 67.9 0.3 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.652 0.739 . . . . 0.0 109.751 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.035 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.0 p -70.31 -130.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 114.13 -1.396 . . . . 0.0 111.831 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.736 ' H ' HG22 ' B' ' 109' ' ' VAL . 25.9 t70 84.89 -5.38 0.95 Allowed 'General case' 0 N--CA 1.485 1.292 0 CA-C-N 119.893 1.224 . . . . 0.0 109.603 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.29 -64.54 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.642 177.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.81 -84.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.265 -179.816 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.96 44.29 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.132 0.491 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.035 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.35 -44.83 14.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.566 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.6 mp0 -48.85 -38.95 23.85 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.782 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.17 -56.72 9.84 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.727 0.694 . . . . 0.0 111.761 179.516 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.772 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.9 OUTLIER -58.33 -48.51 80.31 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.034 -179.005 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -73.41 -26.33 60.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.287 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.91 -25.25 42.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.874 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.266 ' CE2' HD11 ' A' ' 39' ' ' LEU . 1.4 m-30 -87.97 -51.72 5.66 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.6 m-20 144.45 48.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 O-C-N 124.36 1.038 . . . . 0.0 112.096 177.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.772 ' CG1' HD12 ' B' ' 117' ' ' LEU . 5.3 p -150.69 85.76 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.017 ' O ' HD12 ' B' ' 124' ' ' ILE . 43.1 m-80 -68.3 59.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.734 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.017 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.8 OUTLIER 37.42 1.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 178.253 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.09 -62.35 0.57 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.584 1.083 . . . . 0.0 110.373 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -83.33 -31.87 26.87 Favored Glycine 0 C--O 1.223 -0.574 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.169 178.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.769 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.66 -62.02 2.02 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.795 0.438 . . . . 0.0 111.888 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.084 ' CG2' HG22 ' A' ' 28' ' ' VAL . 1.8 t -52.34 -64.7 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.145 0.497 . . . . 0.0 110.929 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.731 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 84.6 p -50.46 -41.63 53.21 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.816 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.425 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 7.6 m -65.7 -51.88 55.8 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.1 -38.52 62.65 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.879 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.889 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.2 mtt -58.11 -55.52 33.83 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.974 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.579 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -50.57 -39.98 51.04 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.21 0.459 . . . . 0.0 111.115 179.29 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -68.79 -52.54 29.19 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.663 0.268 . . . . 0.0 110.754 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 1.006 ' HB3' HD21 ' A' ' 17' ' ' LEU . 22.6 tp10 -68.76 -22.03 64.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.208 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.606 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -80.08 -46.77 15.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.424 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -53.31 59.09 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 121.581 0.705 . . . . 0.0 110.325 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.718 ' HG2' ' HB3' ' B' ' 141' ' ' ALA . 0.5 OUTLIER -71.59 -51.74 21.78 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.166 -178.888 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.953 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 37.15 33.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -179.75 59.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.718 ' HB3' ' HG2' ' B' ' 138' ' ' ARG . . . -168.51 130.28 1.33 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.52 129.0 1.53 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.682 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -166.43 -82.15 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.559 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.42 ' O ' ' HA ' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -145.85 176.58 9.57 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.907 0.384 . . . . 0.0 111.774 -179.48 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -115.72 -89.56 0.56 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.025 -178.929 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.4 m 41.86 68.43 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.533 ' HB2' ' HG3' ' A' ' 43' ' ' ARG . 1.4 pm0 -84.59 141.95 30.31 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.693 178.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -112.47 -85.19 0.58 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 149' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' B' ' 150' ' ' GLU . 10.8 tt0 -160.23 107.59 1.61 Allowed 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.443 0.164 . . . . 0.0 111.443 -179.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 150' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' B' ' 149' ' ' GLN . 0.7 OUTLIER 176.27 148.61 0.11 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.502 179.683 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -177.05 146.86 8.02 Favored Glycine 0 C--N 1.335 0.504 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.118 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.417 ' O ' ' HG3' ' B' ' 154' ' ' GLU . 1.1 ttp 178.89 -34.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.52 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 90.6 t -68.12 95.96 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.575 0 CA-C-O 121.005 0.431 . . . . 0.0 111.891 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' B' ' 152' ' ' MET . 0.5 OUTLIER -141.06 179.14 6.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.89 179.68 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.501 ' CG2' ' CZ2' ' B' ' 172' ' ' TRP . 0.8 OUTLIER -151.94 -42.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.318 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 62.94 84.58 0.14 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.229 0.538 . . . . 0.0 111.347 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.39 32.21 3.11 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 -176.71 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.739 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 6.6 mt -131.88 120.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.73 0.3 . . . . 0.0 111.352 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.29 91.52 0.74 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.294 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 19.8 tpp -96.85 59.65 1.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.987 0.422 . . . . 0.0 111.141 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -176.96 -163.8 0.09 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.747 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 165.72 -61.89 0.23 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.482 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 2.2 m -58.17 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.602 ' CG ' HG23 ' B' ' 122' ' ' VAL . 1.0 OUTLIER -147.89 166.91 26.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.784 179.612 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.678 ' CB ' ' HB2' ' B' ' 120' ' ' TYR . . . -51.24 -88.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.905 ' HB2' HD22 ' A' ' 39' ' ' LEU . 4.3 m-20 -125.82 -74.13 0.61 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.812 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.583 ' O ' ' HA ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER 35.16 -134.4 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.436 0.46 . . . . 0.0 112.095 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' B' ' 168' ' ' GLU . 4.9 m120 65.69 167.14 0.19 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.173 0.442 . . . . 0.0 110.814 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.39 -86.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -158.79 -66.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.696 0.284 . . . . 0.0 111.193 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.501 ' CZ2' ' CG2' ' B' ' 155' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.567 -0.73 . . . . 0.0 109.996 179.002 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.741 " H1'" " O4'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C3'-C2'-C1' 104.923 1.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.741 " O4'" " H1'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 P-O3'-C3' 120.881 0.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.558 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 C3'-C2'-C1' 104.66 1.4 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.604 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C4'-C3'-C2' 104.652 1.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.652 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 C4'-C3'-C2' 104.723 1.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.669 ' H72' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C4'-C3'-C2' 104.583 1.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.456 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 104.552 1.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.589 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.752 0 O4'-C1'-C2' 104.761 -1.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.589 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.496 0 O4'-C1'-C2' 107.216 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.649 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.737 0 C3'-C2'-C1' 105.611 2.08 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.649 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-C2' 107.033 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.585 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C4'-C3'-C2' 103.974 0.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 107.063 0.875 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-C2' 107.005 0.822 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.942 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C5'-C4'-C3' 115.643 0.629 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.942 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 C4'-C3'-C2' 103.964 0.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.475 " O5'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.52 0 O4'-C1'-C2' 106.921 0.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.488 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -0.966 0 C1'-O4'-C4' 106.792 -2.077 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.647 H2'' " O5'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.902 0 C1'-O4'-C4' 107.449 -1.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.647 " O5'" H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 C3'-C2'-C1' 106.49 2.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.565 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 105.191 1.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 O4'-C1'-C2' 107.254 1.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.532 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.022 0 C1'-O4'-C4' 107.655 -1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.532 " O5'" H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.612 0 O4'-C1'-C2' 106.901 0.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.502 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 N19-C1'-C2' 115.444 0.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 102.096 -0.431 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.2 ptp . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 120.65 0.262 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.5 mttp 55.74 68.72 0.82 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.919 0.39 . . . . 0.0 111.554 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.604 ' HG2' ' CE2' ' B' ' 114' ' ' TYR . 5.0 tp60 -69.58 115.15 8.49 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.138 0.494 . . . . 0.0 110.211 178.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -78.1 99.23 6.07 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.778 0.799 . . . . 0.0 109.072 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.818 HD11 HG11 ' A' ' 28' ' ' VAL . 1.9 pt -99.34 120.22 48.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 107.022 -1.474 . . . . 0.0 107.022 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.66 126.21 34.07 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 118.755 -1.178 . . . . 0.0 114.129 -176.661 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.486 ' O ' HG22 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -99.45 109.47 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 175.869 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.632 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 1.6 p -70.67 94.77 1.04 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.865 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -99.59 -120.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.368 -177.803 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 4.7 t70 97.32 11.85 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 CA-C-O 122.088 0.946 . . . . 0.0 109.144 -175.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -170.69 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.386 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.748 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 0.0 OUTLIER -68.74 49.97 0.07 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -176.491 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.677 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.6 OUTLIER 52.26 12.59 0.23 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.448 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.876 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -67.17 -57.4 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.535 0.683 . . . . 0.0 112.159 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.808 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 6.6 mt-30 -50.29 -28.71 8.27 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -62.76 -57.17 11.87 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.416 0.553 . . . . 0.0 111.655 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.977 HD23 ' CE2' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -47.26 -48.56 24.54 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.89 0.852 . . . . 0.0 111.9 -179.187 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.71 ' CB ' ' HA ' ' A' ' 23' ' ' ASN . 3.5 pttt -79.27 -26.41 42.36 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.682 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.7 -22.96 63.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.005 179.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.056 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.01 -41.24 13.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.871 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 167.12 -12.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 177.045 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.594 ' O ' ' N ' ' A' ' 24' ' ' ILE . 75.2 t -109.6 80.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-O 120.539 0.209 . . . . 0.0 111.206 -178.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.074 ' C ' HD12 ' A' ' 24' ' ' ILE . 61.6 m-80 -63.4 60.69 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.185 0.517 . . . . 0.0 111.036 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.074 HD12 ' C ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER 46.01 -21.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 178.597 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.765 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.28 -63.8 0.47 Allowed 'General case' 0 C--O 1.245 0.862 0 CA-C-N 118.534 0.606 . . . . 0.0 112.21 -173.999 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.04 -14.26 72.58 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.29 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.779 HD12 HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -65.97 -61.26 2.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 122.343 0.257 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.966 HG23 HG22 ' A' ' 24' ' ' ILE . 55.7 t -51.09 -59.21 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.693 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 25.7 p -49.35 -36.81 22.58 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.532 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -74.31 -56.08 5.29 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.491 HG23 HD21 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -56.05 -44.37 78.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.696 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.862 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.6 mmt -52.57 -46.12 66.75 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.707 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.455 ' N ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.831 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -60.49 -51.81 67.87 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.684 ' HG3' HD11 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -63.45 -34.08 76.97 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.503 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.678 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -67.17 -45.39 77.12 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.999 0.428 . . . . 0.0 109.906 177.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -53.56 56.68 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.61 0.719 . . . . 0.0 109.986 178.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -68.23 -53.41 24.88 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.123 -178.963 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.876 ' CD2' ' HB1' ' B' ' 166' ' ' ALA . 0.6 OUTLIER 24.23 69.83 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.966 0.907 . . . . 0.0 112.713 179.66 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -168.3 -75.76 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.134 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.29 -176.7 2.97 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.596 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.491 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -113.48 -74.97 0.61 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.86 131.52 44.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.296 0.57 . . . . 0.0 112.409 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.41 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -138.92 75.01 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.326 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 44' ' ' TRP . 5.4 ptpt 48.64 58.73 4.95 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.582 -178.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 44' ' ' TRP . 3.0 t -138.33 72.36 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.084 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -100.37 -53.65 3.06 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.563 0.221 . . . . 0.0 110.979 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -147.95 120.83 8.73 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.777 0.322 . . . . 0.0 111.56 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -145.68 -76.17 0.21 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.244 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 63.67 102.84 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.351 0.596 . . . . 0.0 112.498 178.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.54 103.56 1.21 Allowed Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.556 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.7 ptm -110.31 72.2 0.78 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.174 0.511 . . . . 0.0 111.29 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 p -132.95 80.38 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.485 0.66 . . . . 0.0 110.282 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -108.68 101.35 10.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.723 -178.438 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.35 64.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.831 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.634 ' HB2' ' HE1' ' A' ' 72' ' ' TRP . . . -139.86 165.93 25.98 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.135 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 18.4 mmt180 -160.82 -177.89 6.46 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.711 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.514 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 90.3 m-85 75.62 106.44 0.08 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.857 0.463 . . . . 0.0 111.559 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.9 mt 66.61 82.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.214 0.53 . . . . 0.0 111.057 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.76 98.23 0.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.837 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 14.1 mmm -113.1 173.29 6.46 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 111.841 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -66.44 65.38 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.196 -179.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.29 -84.26 0.52 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.908 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 65' ' ' PHE . 89.9 p -155.2 -88.31 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.477 0.18 . . . . 0.0 111.353 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.419 ' N ' ' OG ' ' A' ' 64' ' ' SER . 0.4 OUTLIER -142.8 -60.95 0.43 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.247 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -160.67 -121.69 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.621 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -95.88 100.69 12.35 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.959 0.409 . . . . 0.0 111.8 -179.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -151.65 29.68 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.825 179.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 28.99 66.47 0.1 Allowed 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -90.65 71.49 6.77 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.173 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.78 -175.84 6.0 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.005 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.634 ' HE1' ' HB2' ' A' ' 56' ' ' ALA . 23.8 m-90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.237 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.418 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 2.9 mpp? . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.465 ' HD3' " H3'" ' C' ' 175' ' ' ' DA' . 0.0 OUTLIER -136.37 135.84 39.13 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.736 0.303 . . . . 0.0 110.503 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.644 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 14.4 tt0 -125.93 120.16 29.67 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.568 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 7.6 ttm-85 -79.69 116.6 19.97 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.197 -178.415 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.901 HD13 HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -113.36 129.77 68.53 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 176.424 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.716 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -129.12 131.7 47.27 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.262 -0.975 . . . . 0.0 112.461 -178.395 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.765 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.96 91.14 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 23.8 p -69.13 67.54 0.17 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 122.258 1.027 . . . . 0.0 109.735 -178.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.73 HG12 HG12 ' B' ' 107' ' ' VAL . 15.0 p -99.72 -129.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 113.717 -1.583 . . . . 0.0 110.623 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.701 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER 161.52 -84.84 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.008 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.453 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 45.2 t -102.8 11.25 37.81 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.815 -0.612 . . . . 0.0 112.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 3.1 t0 -79.24 61.32 3.31 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-N 119.785 1.175 . . . . 0.0 108.105 179.09 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' ' 29' ' ' SER . 66.0 m 63.33 -22.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.995 -1.002 . . . . 0.0 113.146 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.797 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -47.02 -59.53 3.06 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-O 121.14 0.495 . . . . 0.0 110.852 179.399 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.649 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.8 pt20 -48.49 -38.86 21.23 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.927 -177.546 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.678 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -55.98 -41.38 74.71 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.343 0.52 . . . . 0.0 112.051 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.849 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -64.62 -45.97 84.62 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.006 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.797 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -74.55 -26.05 59.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 178.782 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -65.46 -34.27 77.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.531 178.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.707 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.21 -26.87 22.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.661 179.134 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.586 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 31.1 t70 124.76 61.32 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 121' ' ' ASP . 24.2 t -156.0 -47.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.536 ' CG ' ' HB3' ' B' ' 118' ' ' LYS . 12.8 m-80 68.69 -112.55 0.11 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 -176.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.982 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -150.02 1.69 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 177.725 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.421 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.89 -63.44 0.59 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.798 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.37 -30.04 20.39 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.071 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.786 HD22 ' HG ' ' B' ' 117' ' ' LEU . 10.5 tp -56.51 -61.6 2.3 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.624 0.212 . . . . 0.0 110.441 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.982 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -48.76 -60.12 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.748 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 2.2 t -49.0 -46.56 44.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -51.51 39.39 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 23.5 m -59.6 -36.02 75.46 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.584 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.958 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 1.9 mmt -62.9 -57.9 9.23 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.219 -179.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 1.0 OUTLIER -54.49 -33.46 59.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.512 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.04 -52.35 11.28 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' A' ' 17' ' ' LEU . 78.7 mm-40 -71.25 -20.99 62.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.012 0.434 . . . . 0.0 110.363 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.05 -31.88 34.28 Favored 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 123.122 0.569 . . . . 0.0 110.84 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -80.28 -52.55 7.58 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.58 0.705 . . . . 0.0 110.68 179.535 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 -78.72 -36.62 43.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.489 -1.232 . . . . 0.0 112.704 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.056 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 31.61 41.52 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.744 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER 162.26 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.061 0.544 . . . . 0.0 110.646 179.755 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -143.02 151.27 40.65 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.898 0.38 . . . . 0.0 111.811 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.97 -145.56 0.39 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.186 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -150.15 55.04 0.93 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 120.974 0.416 . . . . 0.0 111.523 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -74.49 63.35 1.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.276 0.56 . . . . 0.0 111.41 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.95 129.18 27.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.139 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.564 ' O ' HG13 ' B' ' 146' ' ' VAL . 8.0 p -151.91 89.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.27 0.557 . . . . 0.0 111.958 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' B' ' 148' ' ' ASN . 15.7 mt-10 -141.0 -113.8 0.13 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 148' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' B' ' 147' ' ' GLU . 0.3 OUTLIER 77.0 122.25 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.289 0.566 . . . . 0.0 111.808 179.304 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.08 -55.44 0.15 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.773 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -90.72 174.72 7.33 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.789 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -112.05 -57.53 0.45 Allowed Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.918 -0.658 . . . . 0.0 113.036 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.57 149.52 46.14 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.938 0.399 . . . . 0.0 111.383 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.501 HG22 ' O ' ' B' ' 153' ' ' VAL . 14.4 p -167.7 47.54 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.301 0.572 . . . . 0.0 111.649 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -107.45 165.93 11.03 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.457 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.01 30.59 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.553 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -85.0 125.82 33.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.243 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.5 90.3 3.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.893 0.378 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.4 t80 60.38 66.76 0.91 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.838 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.3 pp -145.15 34.98 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.479 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.54 -177.85 0.17 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.3 ttt -168.72 106.9 0.45 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -136.95 158.08 45.28 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.236 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 131.7 -145.14 16.84 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.612 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.3 -172.18 4.11 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.771 0.32 . . . . 0.0 111.236 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.426 ' O ' ' HB3' ' B' ' 166' ' ' ALA . 30.2 m-85 -118.92 145.51 45.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.434 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.876 ' HB1' ' CD2' ' A' ' 39' ' ' LEU . . . 72.17 9.56 5.96 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -131.61 -77.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.929 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -115.19 50.6 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.228 0.537 . . . . 0.0 110.449 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.34 -29.45 63.82 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.38 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 1.1 pttm 34.75 42.05 0.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.433 ' HB3' ' CE3' ' B' ' 172' ' ' TRP . 93.2 m-20 67.47 -60.43 0.38 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.928 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.433 ' CE3' ' HB3' ' B' ' 171' ' ' ASP . 27.1 p90 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.92 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.862 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 111.075 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.862 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.831 0 P-O3'-C3' 120.739 0.866 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.777 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.484 0 C3'-C2'-C1' 104.814 1.51 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.632 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.411 -0.714 0 C3'-C2'-C1' 105.43 1.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.512 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.783 0 C4'-C3'-C2' 104.79 1.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.538 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C4'-C3'-C2' 104.206 1.006 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.51 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 104.862 1.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.517 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C4'-C3'-C2' 104.037 0.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.517 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.183 0.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.509 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C3'-C2'-C1' 105.689 2.135 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.591 H2'' ' C5 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 104.125 1.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.591 ' C5 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C1'-O4'-C4' 110.81 0.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . 0.413 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 C5'-C4'-O4' 108.712 -0.43 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 N19-C1'-C2' 115.15 0.594 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.874 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 O4'-C1'-C2' 106.696 0.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.874 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.434 -0.392 0 C4'-C3'-C2' 104.182 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C4'-C3' 106.211 0.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.559 " H2'" ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 C3'-C2'-C1' 104.927 1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.559 ' H72' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C3'-C2'-C1' 104.53 1.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.487 " H2'" ' H71' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.714 0 C4'-C3'-C2' 105.061 1.861 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.568 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.412 -0.604 0 C3'-C2'-C1' 106.151 2.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 O4'-C1'-C2' 107.265 1.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.476 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.021 0 C1'-O4'-C4' 107.341 -1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.583 ' C8 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 C1'-O4'-C4' 110.634 0.667 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.583 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 103.824 0.624 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.43 ' C6 ' ' N3 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 101.966 -0.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 111.525 0.195 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.563 ' HE3' ' HA ' ' B' ' 109' ' ' VAL . 1.7 mmmt 65.31 -158.82 0.28 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.844 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 2.8 tp60 -135.79 138.6 42.77 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.186 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.953 ' HG3' HG22 ' B' ' 108' ' ' THR . 8.1 ttm-85 -81.6 98.07 8.17 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.648 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.686 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -97.65 109.62 23.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.753 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.4 OUTLIER -116.95 121.59 41.86 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.921 -177.193 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.883 HG23 HD13 ' B' ' 124' ' ' ILE . 0.8 OUTLIER -98.96 102.55 13.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 176.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.58 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 5.9 p -70.15 67.38 0.3 Allowed 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.941 HG13 ' H ' ' A' ' 10' ' ' ASP . 13.4 p -97.95 -101.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.941 ' H ' HG13 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 70.91 -61.68 0.47 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 104.195 -2.52 . . . . 0.0 104.195 -174.284 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.561 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -36.58 -70.22 0.1 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 112.83 -1.987 . . . . 0.0 108.804 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.79 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -63.62 -61.54 2.25 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 -175.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 171.7 37.31 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 120.186 1.357 . . . . 0.0 113.347 -179.328 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.925 ' CE1' HD13 ' B' ' 105' ' ' ILE . 1.2 t80 -81.32 -50.5 9.43 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.44 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.611 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.1 mm-40 -49.88 -30.12 9.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -176.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.705 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.8 mt -55.5 -59.06 5.36 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.074 0.397 . . . . 0.0 111.306 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.767 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -55.17 -51.26 67.09 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.76 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.538 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -72.25 -25.95 61.82 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.234 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -58.39 -28.87 65.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.433 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.191 ' CE2' HD11 ' B' ' 139' ' ' LEU . 6.4 m-30 -88.09 -42.2 12.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.598 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 149.21 1.82 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 O-C-N 124.294 0.997 . . . . 0.0 112.347 178.455 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.578 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 16.5 t -94.05 71.46 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 121.938 -0.476 . . . . 0.0 112.12 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.958 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -61.43 47.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.958 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 40.33 -4.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 178.756 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.609 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 0.7 OUTLIER -40.86 -55.97 2.33 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 120.066 1.303 . . . . 0.0 110.973 -178.707 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -28.1 24.45 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.499 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -63.45 -64.33 0.93 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 117.325 0.562 . . . . 0.0 110.143 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.75 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.7 t -51.3 -61.22 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.695 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 9.3 p -48.68 -27.24 2.74 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.134 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.2 m -83.25 -53.28 5.88 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.524 HG21 HD21 ' B' ' 127' ' ' LEU . 10.2 m -55.33 -50.82 68.64 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.642 0.734 . . . . 0.0 109.201 178.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.963 ' HE1' HG23 ' B' ' 124' ' ' ILE . 5.3 mmt -48.89 -50.08 36.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.526 -1.216 . . . . 0.0 111.955 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.496 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.93 -47.26 85.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.499 0.19 . . . . 0.0 110.922 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 72.4 m-20 -58.16 -53.97 52.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.765 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' HD21 ' B' ' 117' ' ' LEU . 27.6 mm-40 -69.25 -30.92 69.15 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.399 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -68.34 -30.64 69.66 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.241 0.543 . . . . 0.0 109.668 177.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 3.0 mmt180 -82.4 -52.15 7.17 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.922 0.867 . . . . 0.0 110.104 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -18.69 62.8 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.593 -1.639 . . . . 0.0 114.007 -176.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.077 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER -40.05 140.76 0.54 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 118.421 0.555 . . . . 0.0 111.947 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 40' ' ' ARG . 6.0 tpt180 75.33 -37.49 0.34 Allowed 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 168.18 13.51 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 111.834 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.23 -167.89 0.1 Allowed 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.258 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' A' ' 43' ' ' ARG . 8.3 tpt180 -104.45 121.62 43.82 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.39 . . . . 0.0 112.0 -179.229 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -129.78 68.03 1.44 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.952 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.402 ' NZ ' ' OE1' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -141.87 161.36 38.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.885 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.745 HG13 ' CG2' ' B' ' 146' ' ' VAL . 4.7 p -179.42 139.85 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.966 0.412 . . . . 0.0 111.8 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.402 ' OE1' ' NZ ' ' A' ' 45' ' ' LYS . 5.1 pm0 -132.99 140.59 47.84 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.166 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.455 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -179.59 -154.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.129 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 48' ' ' ASN . 1.4 mp0 75.98 108.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.92 0.391 . . . . 0.0 111.157 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -131.45 122.08 25.64 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -176.32 -148.5 7.04 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.903 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -124.53 -102.22 0.38 Allowed 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.251 0.093 . . . . 0.0 111.251 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 t 63.59 84.95 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.074 0.464 . . . . 0.0 111.126 -179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.669 ' HA ' ' CD2' ' A' ' 72' ' ' TRP . 8.9 pt-20 -74.08 123.87 25.22 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.441 0.638 . . . . 0.0 112.321 -179.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -150.55 44.31 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.744 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.53 77.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.879 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -111.59 -68.69 0.91 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.1 p90 176.52 159.66 0.33 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.189 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.514 HG23 ' N ' ' A' ' 60' ' ' GLU . 5.0 tt -177.22 -53.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.524 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.514 ' N ' HG23 ' A' ' 59' ' ' ILE . 7.9 tp10 -132.02 145.22 51.32 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.465 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.34 55.95 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 0.0 111.011 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -127.38 -175.58 3.49 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.856 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 86.04 104.07 0.74 Allowed Glycine 0 C--N 1.335 0.499 0 C-N-CA 121.101 -0.571 . . . . 0.0 112.303 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.55 -49.41 11.36 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.584 0.192 . . . . 0.0 111.365 -179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -165.72 -61.14 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.32 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.8 56.74 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.898 0.38 . . . . 0.0 110.998 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.596 ' HA ' HD13 ' B' ' 139' ' ' LEU . 19.9 p-10 -100.08 149.15 23.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.915 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 42.98 63.43 1.49 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.403 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.75 60.24 0.16 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.21 0.529 . . . . 0.0 111.437 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.39 -78.23 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.846 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.9 t0 57.19 -176.32 0.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 120.993 0.425 . . . . 0.0 111.849 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.669 ' CD2' ' HA ' ' A' ' 54' ' ' GLU . 6.2 m0 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.033 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.638 ' C ' ' HG2' ' B' ' 102' ' ' LYS . 3.0 mtm . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.615 0.245 . . . . 0.0 111.528 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.638 ' HG2' ' C ' ' B' ' 101' ' ' MET . 0.0 OUTLIER -156.53 170.05 23.25 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.74 179.82 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.73 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 9.8 tt0 -135.45 134.64 39.81 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.507 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 8.6 ttm105 -79.56 116.19 19.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.287 0.565 . . . . 0.0 110.033 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.925 HD13 ' CE1' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -115.4 116.37 52.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.405 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.679 HG23 ' H73' ' D' ' 191' ' ' ' DT' . 0.5 OUTLIER -121.05 127.16 51.44 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -175.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.742 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -103.73 95.64 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.953 HG22 ' HG3' ' A' ' 4' ' ' ARG . 52.8 p -70.9 91.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.938 -1.101 . . . . 0.0 109.93 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.833 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 4.4 m -132.4 -30.17 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -177.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.844 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 7.9 t70 42.38 -88.1 0.01 OUTLIER 'General case' 0 C--N 1.343 0.302 0 CA-C-O 122.451 1.12 . . . . 0.0 108.721 -177.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.577 ' N ' ' O ' ' B' ' 109' ' ' VAL . 2.0 m -60.81 -18.31 54.66 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 112.542 -2.117 . . . . 0.0 114.991 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.833 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -79.5 62.3 3.78 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 120.194 1.361 . . . . 0.0 110.374 -178.572 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 29' ' ' SER . 17.0 m 57.98 -19.73 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.686 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -47.08 -54.24 10.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.496 0.665 . . . . 0.0 110.663 179.301 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.7 pt20 -50.18 -43.85 52.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.717 -1.128 . . . . 0.0 112.614 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.684 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -56.56 -45.16 81.41 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 120.874 0.369 . . . . 0.0 111.864 -179.476 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.98 ' CD1' HD12 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -55.14 -47.62 74.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.774 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -79.25 -33.14 43.8 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.205 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.15 66.51 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.914 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.077 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.67 -43.33 11.4 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.447 178.976 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 151.55 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 177.026 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.658 HG12 HD13 ' B' ' 117' ' ' LEU . 88.6 t -162.07 88.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.774 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -61.93 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.02 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -151.12 -0.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 178.453 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 8.7 t -38.71 -62.39 0.62 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.69 0.281 . . . . 0.0 110.63 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.415 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.99 -28.62 30.77 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.98 HD12 ' CD1' ' B' ' 117' ' ' LEU . 1.2 tt -62.61 -61.91 2.1 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.845 0.322 . . . . 0.0 110.902 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.02 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.9 t -53.09 -61.35 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.822 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.79 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 16.1 p -49.56 -45.58 47.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.5 OUTLIER -83.57 -50.68 8.0 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.806 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.575 ' HB ' HD23 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -54.47 -34.52 61.71 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.767 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.6 mmt -66.55 -52.52 44.78 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.054 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -42.06 61.35 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 122.143 -0.348 . . . . 0.0 111.191 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.3 m-20 -64.38 -55.68 19.42 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.858 0.361 . . . . 0.0 110.173 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.547 ' O ' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -67.25 -23.06 65.65 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.693 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.705 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -72.07 -40.14 68.5 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -52.85 14.12 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.842 0.83 . . . . 0.0 109.521 177.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -45.35 53.9 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.027 -177.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.191 HD11 ' CE2' ' A' ' 20' ' ' TYR . 74.8 mt 35.66 56.77 0.92 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.089 0.956 . . . . 0.0 112.337 -178.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' B' ' 139' ' ' LEU . 19.9 mtm180 -161.05 151.5 17.93 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.239 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.83 134.99 57.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.611 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.78 148.31 31.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.371 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -103.27 132.56 49.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.4 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 33.1 p90 -85.05 149.29 25.67 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.918 0.39 . . . . 0.0 111.533 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.417 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER 51.87 59.64 4.41 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.958 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.745 ' CG2' HG13 ' A' ' 46' ' ' VAL . 10.2 m -82.97 -169.71 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.5 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.35 161.94 29.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.894 0.378 . . . . 0.0 111.544 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -178.71 175.57 1.06 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.946 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.27 119.54 7.3 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.718 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 63.29 -136.5 0.38 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.553 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 172.39 159.17 18.3 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.903 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.422 ' O ' ' HB ' ' B' ' 153' ' ' VAL . 13.9 ptp -106.89 -17.19 14.27 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' B' ' 152' ' ' MET . 40.6 t 76.48 139.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.951 0.405 . . . . 0.0 111.2 -179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.536 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . 0.5 OUTLIER -70.97 -50.62 32.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.804 -179.826 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.532 ' O ' HG12 ' B' ' 155' ' ' VAL . 12.8 t 65.11 -0.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 49.6 81.51 0.06 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.054 0.454 . . . . 0.0 111.592 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -68.83 78.52 0.31 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.427 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 0.1 OUTLIER 66.77 -147.53 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.657 179.209 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.427 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 70.0 mt 72.5 -56.37 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 122.615 0.366 . . . . 0.0 111.945 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' B' ' 159' ' ' ILE . 1.1 tt0 83.99 166.85 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.833 0.453 . . . . 0.0 111.086 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -146.83 134.29 20.83 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.252 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -109.41 64.2 0.61 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.084 0.468 . . . . 0.0 111.039 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -113.5 178.34 18.46 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.943 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 6.7 m -176.15 131.51 0.23 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.324 0.249 . . . . 0.0 110.557 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.626 ' CB ' HG22 ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.97 173.27 7.06 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.19 -179.094 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -83.96 -88.02 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.321 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.05 86.09 0.25 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.0 0.428 . . . . 0.0 110.949 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.421 ' HB2' ' HE1' ' B' ' 165' ' ' PHE . 0.5 OUTLIER -81.57 179.75 7.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.944 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -112.39 39.42 2.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.442 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.25 -165.78 0.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.608 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -78.58 -141.14 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.178 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.536 ' HB2' ' HB2' ' B' ' 154' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.247 0 CA-C-O 118.779 -0.629 . . . . 0.0 111.299 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.75 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.527 0.915 0 C3'-C2'-C1' 105.817 2.226 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.75 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.631 0 C3'-C2'-C1' 105.914 2.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.727 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.526 0 O4'-C1'-C2' 107.14 0.945 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.58 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C4'-C3'-C2' 104.716 1.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.567 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.933 0 C4'-C3'-C2' 104.731 1.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.567 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.645 0 C4'-C3'-C2' 103.961 0.761 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.51 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 105.237 1.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.51 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 105.244 -0.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.429 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 C3'-C2'-C1' 104.135 1.025 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.536 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -1.009 0 C3'-C2'-C1' 105.037 1.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.605 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 C1'-O4'-C4' 110.56 0.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.605 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 N19-C1'-C2' 115.238 0.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 C1'-O4'-C4' 110.491 0.565 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.828 " O5'" H5'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 N19-C1'-C2' 115.202 0.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.828 H5'' " O5'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-C2' 107.028 0.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 C3'-C2'-C1' 102.051 -0.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.593 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 O4'-C1'-C2' 106.993 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.609 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.905 0 C4'-C3'-C2' 104.787 1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.679 ' H73' HG23 ' B' ' 106' ' ' THR . . . . . . . . 0 C3'--C2' 1.525 0.691 0 C3'-C2'-C1' 105.26 1.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.496 " O5'" H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C3'-C2'-C1' 104.332 1.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.507 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.409 -0.837 0 C4'-C3'-C2' 104.785 1.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.476 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C1'-O4'-C4' 110.78 0.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.476 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.982 0 C1'-O4'-C4' 106.894 -2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.433 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.69 0 O4'-C1'-C2' 107.316 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.433 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.686 0 C4'-C3'-C2' 104.436 1.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.406 ' C6 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 101.587 -0.795 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.737 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 17.9 mmtm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 121.002 0.43 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.504 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 56.0 tt0 -112.35 120.4 41.56 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.205 0.526 . . . . 0.0 111.858 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.017 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -77.9 109.1 11.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.999 0.904 . . . . 0.0 111.798 -179.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.823 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -110.65 117.16 54.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.379 178.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.876 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -133.1 134.37 44.17 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 118.262 -1.375 . . . . 0.0 114.48 -177.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.874 HG12 HD13 ' B' ' 124' ' ' ILE . 1.4 m -99.72 111.68 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.969 HG23 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -71.6 67.85 0.56 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.013 -0.43 . . . . 0.0 111.975 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.806 HG22 HG22 ' A' ' 7' ' ' VAL . 3.2 m -99.03 -120.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.721 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.687 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 6.1 t70 157.61 -85.09 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.721 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -102.04 12.36 36.97 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 119.237 -0.411 . . . . 0.0 112.094 178.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.537 ' C ' ' H ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -73.43 60.39 0.63 Allowed 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.355 0.98 . . . . 0.0 108.47 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.558 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 48.8 m 61.52 -23.54 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.737 ' CG ' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -48.5 -60.63 2.53 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 123.173 0.589 . . . . 0.0 111.07 179.722 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.721 ' HG2' ' HA ' ' A' ' 11' ' ' SER . 0.8 OUTLIER -48.95 -36.94 18.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.804 -176.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.57 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.34 -49.52 77.5 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.915 ' CD1' HD22 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -51.57 -56.33 14.11 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.417 0.627 . . . . 0.0 111.653 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 4.7 pttt -70.43 -28.38 64.99 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.72 -26.0 68.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.677 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.871 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.76 -41.18 13.48 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.98 178.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.558 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 157.18 35.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 177.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.597 ' CG1' ' O ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -167.56 96.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 122.149 0.975 . . . . 0.0 113.527 -179.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.968 ' O ' HD12 ' A' ' 24' ' ' ILE . 34.1 m-80 -67.26 66.23 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.134 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.968 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER 36.34 -6.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -38.36 -61.74 0.66 Allowed 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.569 1.077 . . . . 0.0 111.559 -177.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.83 -33.27 34.2 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.294 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.948 HD23 ' CG2' ' A' ' 24' ' ' ILE . 22.4 tp -62.36 -61.97 2.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 117.367 0.584 . . . . 0.0 111.707 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.794 HG23 ' CG2' ' A' ' 24' ' ' ILE . 17.6 t -46.15 -68.54 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 O-C-N 123.381 0.425 . . . . 0.0 110.204 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.583 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 2.9 m -49.96 -37.01 30.2 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -64.13 -51.41 64.06 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.2 m -60.99 -39.85 91.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.057 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.847 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 6.0 mmt -58.41 -57.77 11.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.817 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.417 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -52.79 -35.4 56.69 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.998 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -70.65 -55.87 7.75 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.61 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.962 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -69.75 -17.53 63.44 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 177.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -75.83 -50.54 14.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -56.49 10.03 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.12 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.872 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.47 -179.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp . . . . . 0 N--CA 1.465 0.325 0 N-CA-C 110.486 -0.19 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.687 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 4.9 tt0 -113.59 116.51 29.62 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.278 0.561 . . . . 0.0 111.753 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.969 ' CZ ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -79.07 113.92 17.6 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.653 178.34 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.737 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -106.05 122.65 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.755 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.876 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -125.45 123.78 39.99 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.469 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.823 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.8 104.1 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 173.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 1.017 HG22 ' HG3' ' A' ' 4' ' ' ARG . 55.2 p -70.24 89.79 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.826 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.5 t -82.75 -131.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.0 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.737 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 22.3 t0 86.34 -3.39 0.73 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -175.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.5 m -137.04 -59.27 0.7 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.514 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.583 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -46.15 -91.6 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.5 OUTLIER 179.11 36.53 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.528 -0.733 . . . . 0.0 110.63 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.936 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -82.24 -46.16 14.07 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -178.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.562 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.82 -34.73 12.97 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.772 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -59.85 -56.93 15.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.424 0.556 . . . . 0.0 112.288 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.962 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -53.46 -40.61 65.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 119.856 -0.737 . . . . 0.0 111.495 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.659 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -79.15 -26.89 42.72 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 0.0 110.196 178.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -62.03 -29.82 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.738 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.705 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -88.0 -44.07 11.27 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.708 178.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.705 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 t0 160.21 15.82 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 177.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.469 ' O ' HD23 ' B' ' 117' ' ' LEU . 60.9 t -154.28 93.35 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-N 118.848 0.749 . . . . 0.0 112.938 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.606 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.3 m120 -56.58 -97.64 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.73 -1.28 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.9 OUTLIER -39.27 -64.47 0.46 Allowed 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.202 -177.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.22 -26.63 35.99 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 121.1 -0.572 . . . . 0.0 112.449 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.728 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.79 -61.09 2.75 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.065 0.46 . . . . 0.0 110.641 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.19 HG13 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -49.03 -66.38 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.965 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.584 ' N ' HG12 ' B' ' 128' ' ' VAL . 94.9 p -49.27 -35.22 17.23 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 29.0 m -70.76 -53.72 14.43 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.447 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -62.55 -41.0 98.61 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.111 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.19 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -56.72 -51.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.325 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.558 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.81 -39.3 71.16 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 121.024 -0.271 . . . . 0.0 111.09 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -47.46 65.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.99 -27.82 68.42 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.025 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.57 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -74.13 -52.33 12.88 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 122.919 0.487 . . . . 0.0 110.607 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.482 ' HA ' ' HD2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -54.16 -50.49 66.87 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.417 0.627 . . . . 0.0 110.724 178.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.457 ' CZ ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.77 0 CA-C-N 114.964 -1.016 . . . . 0.0 112.561 -177.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.357 0 CA-C-O 121.111 0.482 . . . . 0.0 111.71 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.615 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 34.4 tp60 -111.36 119.48 38.99 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.742 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.919 ' HG3' HG22 ' B' ' 108' ' ' THR . 9.0 ttp-105 -78.17 107.92 11.1 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.327 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.793 HD11 HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -109.33 116.47 52.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.128 178.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -121.51 124.03 43.43 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 119.8 -0.76 . . . . 0.0 112.921 -177.414 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.792 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.69 108.44 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.494 ' HB ' ' CG ' ' B' ' 102' ' ' LYS . 11.4 p -70.5 88.73 0.68 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.156 0.503 . . . . 0.0 110.54 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.148 HG21 ' CD1' ' A' ' 14' ' ' TYR . 15.8 m -81.9 -146.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.852 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.692 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 4.3 t70 87.82 -10.97 0.52 Allowed 'General case' 0 C--N 1.353 0.721 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -176.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 t -116.53 -69.84 0.83 Allowed 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.373 177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -51.68 -86.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.645 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 0.4 OUTLIER 178.77 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 120.416 1.462 . . . . 0.0 112.997 -178.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.148 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -82.96 -41.06 19.25 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.33 0.652 . . . . 0.0 112.615 179.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 1.5 mp0 -49.11 -42.91 40.74 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -175.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.717 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -55.26 -42.71 73.86 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.469 1.031 . . . . 0.0 112.445 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.949 HD12 ' HG2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -63.37 -55.12 27.08 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.108 -179.079 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -67.77 -26.0 65.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.495 0.664 . . . . 0.0 110.015 178.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -61.45 -31.77 71.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.594 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.579 ' CE2' HD22 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.5 -42.52 12.05 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 118.396 -0.811 . . . . 0.0 109.995 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 152.88 26.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.499 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.421 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.3 t -156.43 91.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 O-C-N 122.106 -0.371 . . . . 0.0 111.904 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -54.78 -92.01 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.952 HG21 HG22 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -153.84 1.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 115.874 1.805 . . . . 0.0 115.874 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.844 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.3 p -38.97 -63.72 0.51 Allowed 'General case' 0 C--O 1.246 0.915 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.236 -177.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.86 -23.39 52.89 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.443 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.943 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -65.12 -60.88 2.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.825 0.313 . . . . 0.0 111.111 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.812 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.7 t -50.44 -65.28 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.401 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.651 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 12.9 p -48.62 -36.1 15.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.3 m -78.04 -52.28 9.02 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.667 HG23 HD21 ' B' ' 127' ' ' LEU . 0.7 OUTLIER -60.51 -41.15 93.75 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.605 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.795 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.2 mmt -54.87 -47.02 74.76 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.526 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.4 tt0 -60.46 -52.6 64.5 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.7 0.286 . . . . 0.0 110.805 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -48.1 76.41 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.014 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.586 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -69.8 -33.07 71.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.147 178.02 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.686 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -64.56 -45.71 85.89 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.513 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -62.26 -51.33 68.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.332 177.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? . . . . . 0 N--CA 1.448 -0.546 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.429 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.505 ' HB3' HG23 ' A' ' 9' ' ' VAL . 24.9 tt0 -98.67 114.11 26.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.651 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.463 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 14.7 ttm-85 -78.29 105.35 9.47 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.401 0.619 . . . . 0.0 112.233 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.792 HG12 HG13 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -106.63 126.4 62.47 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 176.293 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.694 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -124.44 127.81 48.07 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 119.94 -0.704 . . . . 0.0 112.154 -177.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.844 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.2 t -100.14 93.85 3.2 Favored 'Isoleucine or valine' 0 C--N 1.346 0.44 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.919 HG22 ' HG3' ' A' ' 4' ' ' ARG . 73.3 p -70.62 66.87 0.35 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.811 0.815 . . . . 0.0 109.434 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.754 HG12 HG12 ' B' ' 107' ' ' VAL . 7.5 p -90.55 -124.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 CA-C-N 113.905 -1.498 . . . . 0.0 108.816 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.646 ' H ' HG22 ' B' ' 109' ' ' VAL . 21.7 t70 158.41 -92.22 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.652 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 26.5 t -97.61 9.57 42.16 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.226 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.71 ' HB2' ' CG2' ' B' ' 109' ' ' VAL . 52.8 m-20 -80.37 68.91 6.7 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 117.794 -1.563 . . . . 0.0 108.242 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.758 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 61.97 -24.3 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.167 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.643 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -48.69 -62.36 1.55 Allowed 'General case' 0 C--N 1.348 0.506 0 CA-C-O 120.895 0.379 . . . . 0.0 111.313 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.652 ' HG2' ' HA ' ' B' ' 111' ' ' SER . 0.8 OUTLIER -49.85 -34.56 20.26 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.134 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.686 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -59.75 -56.1 26.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.832 HD21 HD13 ' B' ' 127' ' ' LEU . 0.1 OUTLIER -54.04 -44.46 71.05 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 120.412 -0.515 . . . . 0.0 112.226 -177.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.712 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER -70.57 -25.66 63.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 178.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.576 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -63.88 -28.02 69.56 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.02 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.804 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -88.35 -41.4 12.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.749 -1.119 . . . . 0.0 110.715 178.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.641 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 m-20 146.42 45.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.429 ' HB ' HD23 ' B' ' 117' ' ' LEU . 25.7 t -150.9 -43.85 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.712 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 5.2 m-80 73.06 -121.09 0.05 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.143 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -138.3 0.26 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 C-N-CA 119.515 -0.874 . . . . 0.0 113.308 177.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.438 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.65 -63.14 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.094 0.473 . . . . 0.0 109.784 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.636 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -88.21 -33.98 10.13 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.329 178.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.832 HD13 HD21 ' B' ' 117' ' ' LEU . 9.1 tp -54.65 -62.35 1.71 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 117.149 0.475 . . . . 0.0 111.168 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.143 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.9 t -52.07 -62.34 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.313 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 20.9 p -52.46 -44.31 65.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.636 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -73.22 -49.14 29.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' B' ' 135' ' ' GLU . 2.8 m -53.72 -52.25 60.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.963 ' SD ' HG13 ' B' ' 128' ' ' VAL . 8.9 mtt -55.37 -53.77 51.98 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -52.58 -42.59 64.65 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.443 179.519 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -65.64 -54.45 27.48 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' B' ' 131' ' ' THR . 6.7 mm-40 -60.65 -28.05 68.28 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.717 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -76.02 -50.91 13.51 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.602 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -49.16 62.51 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.964 0.888 . . . . 0.0 109.529 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 . . . . . 0 N--CA 1.443 -0.803 0 CA-C-N 113.579 -1.646 . . . . 0.0 113.412 -178.122 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 120.463 0.173 . . . . 0.0 110.905 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.53 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.2 OUTLIER -123.93 102.12 7.61 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.405 0.622 . . . . 0.0 111.526 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.854 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.9 ttm105 -79.55 111.32 15.7 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.546 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.873 HG21 ' CD2' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -110.26 122.79 65.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.199 179.464 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.698 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.63 131.93 43.61 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.406 -0.918 . . . . 0.0 112.687 -177.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.993 HG22 HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.19 112.17 31.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.053 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.509 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 7.0 p -70.85 81.56 0.64 Allowed 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.923 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.101 HG21 ' CD2' ' A' ' 14' ' ' TYR . 7.0 m -77.39 -137.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.156 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.704 ' HB2' ' HB2' ' B' ' 103' ' ' GLN . 36.9 t70 84.88 -11.47 0.78 Allowed 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -122.13 -63.11 1.32 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.187 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.652 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 0.8 OUTLIER -48.16 -97.94 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.197 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.601 ' O ' ' HB2' ' B' ' 132' ' ' MET . 4.0 m -174.23 41.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.144 -0.972 . . . . 0.0 111.814 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.101 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -80.6 -41.59 23.7 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.0 -46.36 43.78 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -175.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -53.55 -44.82 69.55 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.574 0.625 . . . . 0.0 112.237 -179.351 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.085 HD23 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -63.5 -48.28 78.25 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.444 0.64 . . . . 0.0 111.626 -179.826 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -76.93 -29.97 55.9 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.145 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.44 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.06 -29.71 70.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.764 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 1.085 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.82 -43.71 11.03 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.61 179.012 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 155.51 37.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.863 ' HB ' HD22 ' A' ' 17' ' ' LEU . 47.6 t -150.82 86.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 121.115 -0.991 . . . . 0.0 113.062 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.976 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -76.59 54.38 0.95 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.164 0.506 . . . . 0.0 111.069 179.081 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.011 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.7 OUTLIER 39.55 -4.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 119.339 3.089 . . . . 0.0 119.339 178.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.472 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -38.69 -63.88 0.48 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 120.267 1.394 . . . . 0.0 110.578 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.511 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.35 -33.38 11.81 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.923 -0.655 . . . . 0.0 111.862 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.682 ' CD1' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -52.61 -61.64 2.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.919 0.39 . . . . 0.0 110.764 178.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.011 HG23 ' CG2' ' A' ' 24' ' ' ILE . 0.9 OUTLIER -53.18 -66.31 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.862 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.655 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 18.5 m -50.97 -41.74 59.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.46 -54.33 11.0 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.776 HG21 HG21 ' B' ' 131' ' ' THR . 17.1 m -54.12 -39.3 66.31 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.78 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.035 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.46 -51.31 58.13 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.178 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.549 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -48.6 -33.37 9.67 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.992 0.814 . . . . 0.0 110.16 179.69 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.3 -57.18 9.07 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HB2' HD21 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -77.86 -10.34 59.51 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.603 178.537 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.929 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.49 -28.95 20.49 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.11 -54.0 5.64 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.641 0.734 . . . . 0.0 109.708 179.066 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.794 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.188 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.509 ' HD3' ' O ' ' A' ' 8' ' ' THR . 4.3 mmtm . . . . . 0 N--CA 1.463 0.208 0 CA-C-O 120.56 0.219 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.744 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -94.87 113.58 25.33 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.0 0.428 . . . . 0.0 112.012 -179.473 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.61 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.46 97.81 7.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.942 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.768 HD13 ' CD1' ' A' ' 14' ' ' TYR . 8.9 pt -100.04 113.77 36.51 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.958 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.698 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -117.98 119.32 34.43 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.571 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.19 102.78 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 174.082 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.854 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 14.3 p -67.97 89.8 0.3 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.909 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.97 HG21 ' CB ' ' B' ' 114' ' ' TYR . 5.8 t -80.97 -126.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.455 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.66 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 81.65 -10.65 1.14 Allowed 'General case' 0 C--N 1.351 0.648 0 CA-C-N 118.86 0.755 . . . . 0.0 109.188 -176.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.3 m -128.25 -61.88 1.07 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.001 177.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.655 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.18 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -178.374 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.446 ' HB3' ' O ' ' A' ' 29' ' ' SER . 9.6 t -179.57 41.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.185 0.902 . . . . 0.0 111.428 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.97 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.68 -50.22 8.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.748 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.523 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.61 -41.35 41.97 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.787 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.929 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -51.33 -56.43 13.11 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.539 0.609 . . . . 0.0 110.981 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.684 HD13 ' CE2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER -45.9 -52.68 11.08 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.809 0.814 . . . . 0.0 111.56 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 15.3 pttt -79.43 -30.3 42.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.768 -1.105 . . . . 0.0 111.877 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -66.52 -22.11 66.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.471 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.684 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.13 -41.99 12.65 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.167 178.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.656 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.1 t70 170.81 25.43 0.0 OUTLIER 'General case' 0 C--N 1.359 0.999 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.58 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.4 OUTLIER -170.29 107.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.064 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.86 ' O ' HD12 ' B' ' 124' ' ' ILE . 71.6 m-80 -66.8 50.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.732 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.035 HG21 ' CE ' ' A' ' 32' ' ' MET . 1.9 pp 34.89 2.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 119.409 3.115 . . . . 0.0 119.409 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.44 -62.04 0.63 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.294 0.497 . . . . 0.0 110.689 -178.209 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -77.62 -24.7 64.51 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.645 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.653 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.8 tm? -67.67 -57.11 6.96 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.999 0.4 . . . . 0.0 110.774 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.977 HG23 ' HB ' ' B' ' 124' ' ' ILE . 88.3 t -50.19 -73.17 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.895 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.795 ' HA ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.43 -33.89 15.2 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 19.8 m -68.81 -47.36 66.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.776 HG21 HG21 ' A' ' 31' ' ' THR . 89.5 m -59.06 -39.61 82.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.516 177.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.028 ' HA ' HD12 ' A' ' 17' ' ' LEU . 14.7 mmm -57.54 -57.38 12.93 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -59.34 -38.11 79.54 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.074 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -68.15 -46.74 69.96 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.879 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -71.2 -28.82 64.5 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.601 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.823 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.96 -25.67 43.51 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.304 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 6.4 mtt-85 -82.54 -53.45 5.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.812 0.815 . . . . 0.0 110.487 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.777 0 CA-C-N 114.054 -1.43 . . . . 0.0 114.164 -177.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.0 ptpt . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 120.858 0.361 . . . . 0.0 111.617 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.622 ' O ' ' HA ' ' B' ' 108' ' ' THR . 34.5 tp60 -95.9 118.51 32.67 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.211 0.529 . . . . 0.0 110.997 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.969 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.84 105.82 9.28 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.698 0.761 . . . . 0.0 111.584 -178.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.72 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -108.99 111.51 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 177.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.66 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -116.49 128.38 55.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.517 -177.424 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.94 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -98.87 101.51 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 176.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.436 ' CG2' ' NH1' ' B' ' 104' ' ' ARG . 2.3 p -69.72 67.81 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.8 0.81 . . . . 0.0 109.272 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.982 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.4 p -79.9 -135.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.384 -178.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.785 ' H ' HG22 ' A' ' 9' ' ' VAL . 5.8 t70 91.2 -0.33 0.17 Allowed 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 119.591 1.087 . . . . 0.0 109.165 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.5 -55.98 0.69 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.673 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 0.6 OUTLIER -45.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 123.526 0.516 . . . . 0.0 111.579 -179.487 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.561 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 0.3 OUTLIER 176.59 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 119.176 0.898 . . . . 0.0 111.771 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.39 -43.15 16.21 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.8 mp0 -49.83 -39.99 40.68 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -176.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.816 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -57.28 -56.6 19.75 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.829 HD13 HD11 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -54.15 -47.35 72.05 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.021 -0.672 . . . . 0.0 112.268 -177.36 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.719 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 pttt -73.24 -25.76 60.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.301 0.572 . . . . 0.0 110.01 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.1 -28.61 69.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.052 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.32 -43.12 11.77 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.305 178.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.6 t70 163.84 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.725 ' HB ' HD23 ' A' ' 17' ' ' LEU . 47.6 t -137.89 89.06 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 119.624 1.102 . . . . 0.0 113.588 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.6 m-80 -68.93 61.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.946 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 45.41 -16.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 117.871 2.545 . . . . 0.0 117.871 -179.362 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 23' ' ' ASN . 7.8 t -37.61 -64.49 0.38 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.758 1.163 . . . . 0.0 112.013 -176.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.91 -22.45 57.72 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.829 HD11 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.81 -62.05 1.72 Allowed 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 122.728 0.411 . . . . 0.0 110.767 179.644 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.97 HG23 ' CG2' ' A' ' 24' ' ' ILE . 5.2 t -48.79 -63.01 0.4 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.98 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.684 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.825 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -48.44 -36.45 14.94 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 25.4 m -69.91 -52.66 22.76 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.615 HG21 ' HB ' ' B' ' 131' ' ' THR . 20.6 m -61.23 -39.24 89.55 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.86 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.885 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.7 mmt -60.06 -57.88 10.94 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.893 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.448 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 3.0 tt0 -57.16 -35.22 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -50.41 33.13 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.848 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.5 tp10 -72.96 -16.34 61.53 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.685 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -86.01 -47.95 9.12 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.815 0.446 . . . . 0.0 110.117 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 1.2 mmt180 -55.58 -52.03 65.12 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.57 0.7 . . . . 0.0 110.77 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 . . . . . 0 N--CA 1.445 -0.688 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.957 -178.214 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 36.4 tt0 -101.97 114.6 28.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.243 0.544 . . . . 0.0 109.975 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.498 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.9 ttm-85 -79.32 99.93 7.34 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.282 -177.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.65 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -108.1 110.31 31.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.66 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -107.15 122.19 46.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.863 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.72 HG13 HG12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.08 95.11 3.76 Favored 'Isoleucine or valine' 0 C--N 1.343 0.285 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.969 HG22 ' HG3' ' A' ' 4' ' ' ARG . 74.3 p -68.16 94.03 0.48 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.248 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.088 HG21 ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -80.9 -132.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.925 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.497 ' H ' HG12 ' B' ' 109' ' ' VAL . 19.9 t70 91.23 -12.53 0.24 Allowed 'General case' 0 C--N 1.351 0.637 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -129.66 -54.27 1.15 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.445 178.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.825 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.7 OUTLIER -48.72 -99.63 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -179.2 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.229 -0.92 . . . . 0.0 110.828 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.088 ' HB3' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.27 -39.14 21.23 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.944 1.091 . . . . 0.0 113.944 -179.062 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.3 -39.63 22.43 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -175.183 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.685 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -60.89 -56.68 18.27 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 1.105 HD22 HG11 ' B' ' 122' ' ' VAL . 1.5 mt -57.46 -38.19 74.09 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.318 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.63 ' HD3' ' OH ' ' B' ' 114' ' ' TYR . 0.8 OUTLIER -79.35 -31.23 42.96 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.155 0.503 . . . . 0.0 111.132 178.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.585 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.67 -28.92 67.69 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.364 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 1.072 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.28 -42.62 12.13 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 117.469 -1.253 . . . . 0.0 110.977 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.708 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 2.7 p30 151.35 12.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 1.105 HG11 HD22 ' B' ' 117' ' ' LEU . 1.4 p -89.83 -31.17 5.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 118.882 0.764 . . . . 0.0 112.886 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.008 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m-80 36.04 41.12 0.12 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.028 0.531 . . . . 0.0 111.621 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.008 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.5 OUTLIER 43.74 -8.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 N-CA-C 118.494 2.775 . . . . 0.0 118.494 179.438 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.94 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.87 -63.29 0.54 Allowed 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.114 1.324 . . . . 0.0 110.026 -177.842 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.43 -23.19 54.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.024 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.686 ' CD1' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.72 -61.05 2.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.521 0.328 . . . . 0.0 111.209 179.892 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.844 HG23 ' CG2' ' B' ' 124' ' ' ILE . 17.2 t -50.13 -63.69 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.459 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 13.5 p -49.9 -43.83 49.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 23.5 m -68.87 -53.68 19.88 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.633 HG22 ' O ' ' B' ' 128' ' ' VAL . 2.1 t -56.14 -40.23 73.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.688 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.814 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -62.09 -57.75 10.4 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.282 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.561 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 1.3 tp60 -49.65 -40.9 41.22 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.038 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -69.56 -57.12 5.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.072 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.719 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -66.81 -14.73 62.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.333 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.14 -52.79 5.05 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.198 0.599 . . . . 0.0 111.689 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -54.96 -56.32 20.93 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.379 0.609 . . . . 0.0 111.825 -178.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.438 -1.066 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.095 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.991 0.424 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 108' ' ' THR . 29.3 tp60 -104.2 107.38 18.26 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.219 0.533 . . . . 0.0 110.235 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 5.6 ttm180 -78.19 102.87 7.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.72 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.0 ' CD1' HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -108.1 127.19 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 177.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.676 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -129.73 127.77 41.11 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.81 -0.756 . . . . 0.0 112.529 -176.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.709 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.57 109.06 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.363 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' B' ' 102' ' ' LYS . 5.8 p -70.56 94.31 0.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.083 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.026 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.8 t -84.6 -132.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.827 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.675 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 3.8 t70 82.63 -10.32 1.07 Allowed 'General case' 0 C--N 1.35 0.627 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.1 m -128.4 -58.18 1.19 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.204 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 1.3 m-20 -49.7 -101.96 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -177.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 36.02 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.558 -0.714 . . . . 0.0 110.701 -178.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.026 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.01 -39.15 23.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.303 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.12 -45.52 33.12 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -176.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.807 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -54.59 -47.32 73.49 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.943 0.792 . . . . 0.0 111.893 -179.615 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.848 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.82 -49.86 76.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.117 -179.461 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.5 OUTLIER -73.99 -26.06 60.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.299 178.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -65.38 -27.53 68.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.409 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.671 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.1 -42.19 12.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.468 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.6 21.34 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 176.287 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.6 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 61.7 t -156.71 94.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.597 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' ' HE1' ' B' ' 132' ' ' MET . 3.3 p30 -60.34 -93.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.079 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -148.61 3.08 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 179.072 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 24' ' ' ILE . 4.1 t -38.03 -63.17 0.5 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.662 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.05 -29.99 18.63 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.507 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.728 ' HB3' HG22 ' A' ' 24' ' ' ILE . 13.0 tp -56.52 -61.97 2.05 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 117.282 0.541 . . . . 0.0 110.718 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.079 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.1 t -54.66 -57.09 7.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-O 121.774 0.797 . . . . 0.0 109.097 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.85 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 60.2 m -47.38 -49.84 23.71 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.802 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.5 OUTLIER -80.75 -47.4 13.99 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.78 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.34 -43.83 92.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.69 -179.321 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.049 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.6 mmt -54.01 -57.11 12.26 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.319 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -54.86 -36.97 65.66 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -52.88 22.03 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.919 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.6 tp10 -70.78 -25.31 62.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.408 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.748 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -81.88 -25.22 35.21 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 122.839 0.456 . . . . 0.0 110.747 178.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -79.66 -46.99 16.14 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 122.095 0.95 . . . . 0.0 108.835 178.05 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.959 0 CA-C-N 113.233 -1.803 . . . . 0.0 113.172 -177.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 22.7 mmmt . . . . . 0 N--CA 1.466 0.36 0 CA-C-O 120.678 0.275 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.648 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -104.88 107.68 18.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.119 0.485 . . . . 0.0 111.014 179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.501 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.2 OUTLIER -78.59 106.97 10.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.856 0.836 . . . . 0.0 111.875 -178.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.754 HD11 HG11 ' B' ' 128' ' ' VAL . 1.4 pt -110.04 120.77 61.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.089 178.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.676 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.01 125.8 32.38 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -177.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 1.0 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.47 103.84 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 82.1 p -68.94 90.15 0.43 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.192 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.1 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.2 t -79.22 -134.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.296 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 35.3 t70 90.54 -5.74 0.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.711 0.767 . . . . 0.0 109.192 -176.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -134.61 -59.37 0.81 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.156 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.85 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 1.5 m-20 -47.98 -95.03 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.578 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 1.2 m -177.93 35.0 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.362 -0.836 . . . . 0.0 111.404 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.1 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -80.6 -43.97 19.7 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.645 0.778 . . . . 0.0 111.269 179.302 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.702 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 81.8 mt-30 -49.81 -38.29 34.01 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.68 -177.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.748 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -57.27 -56.52 20.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.528 0.603 . . . . 0.0 112.211 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 1.049 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -54.6 -40.07 68.51 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.733 -178.29 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.24 -32.3 43.79 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.458 0.647 . . . . 0.0 110.938 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.556 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -62.98 -28.88 70.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.611 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.662 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.3 OUTLIER -88.02 -46.28 9.47 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.661 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 3.2 t0 165.87 12.72 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.447 ' O ' HD22 ' B' ' 117' ' ' LEU . 72.7 t -153.69 91.99 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-N 118.783 0.719 . . . . 0.0 112.014 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.0 OUTLIER -59.3 -102.36 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.012 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.37 4.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 179.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.4 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -44.41 -64.03 0.77 Allowed 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.327 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.463 ' HA2' ' OG ' ' B' ' 129' ' ' SER . . . -86.1 -29.74 24.72 Favored Glycine 0 C--N 1.337 0.631 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.071 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.682 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.4 -61.38 2.37 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 122.342 0.257 . . . . 0.0 110.649 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.999 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -54.64 -61.88 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-O 121.347 0.594 . . . . 0.0 110.103 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.874 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 9.0 p -47.99 -44.05 30.32 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -78.65 -47.79 16.34 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.447 0.567 . . . . 0.0 109.972 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.433 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 3.2 m -60.13 -47.69 84.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.322 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.848 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 4.5 mmt -54.64 -53.63 52.28 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.484 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -49.39 -40.11 34.86 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -69.75 -48.99 57.37 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 121.367 -0.133 . . . . 0.0 110.911 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -74.66 -13.57 60.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.914 0.388 . . . . 0.0 110.214 178.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.807 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.75 -48.52 7.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -51.6 -54.53 26.69 Favored 'General case' 0 CA--C 1.5 -0.97 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.266 178.701 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.505 -178.662 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 120.581 0.229 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.661 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 4.2 tt0 -124.23 121.8 36.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.584 0.707 . . . . 0.0 111.771 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.889 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.7 ttp-105 -79.81 113.25 17.82 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.069 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.813 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -103.4 124.35 57.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.65 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.645 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -129.99 123.61 31.01 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.434 -0.906 . . . . 0.0 111.844 -177.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.877 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.67 108.46 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.9 p -70.9 89.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.04 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.1 t -86.41 -132.31 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 119.106 -0.473 . . . . 0.0 111.985 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.9 t70 82.4 -8.82 1.21 Allowed 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -175.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -130.1 -63.23 0.91 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.119 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.713 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.72 -89.84 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.9 t 176.53 39.55 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.705 0.764 . . . . 0.0 110.772 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.04 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.71 -44.25 14.67 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.877 -179.251 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.623 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -47.53 -37.9 13.04 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -175.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.81 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.83 -56.6 19.27 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.721 0.692 . . . . 0.0 112.458 -179.628 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.919 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.65 -43.87 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.457 0.646 . . . . 0.0 111.378 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.738 ' HB3' ' HB3' ' A' ' 23' ' ' ASN . 4.2 pttt -79.65 -30.95 41.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.605 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.34 -29.05 67.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.873 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.667 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.12 -46.55 9.2 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.463 178.459 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 154.83 19.72 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 176.125 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.657 ' O ' HD12 ' A' ' 17' ' ' LEU . 75.0 t -156.58 84.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 118.165 0.438 . . . . 0.0 111.678 -178.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.738 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -58.08 -96.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.067 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -138.98 -3.71 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 115.664 1.728 . . . . 0.0 115.664 -179.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 78.3 p -39.05 -64.23 0.47 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-N 119.057 0.844 . . . . 0.0 109.501 -179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.468 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -85.22 -29.99 26.46 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.65 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 4.9 tp -58.64 -61.98 2.2 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.875 0.338 . . . . 0.0 110.83 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.067 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.03 -67.25 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.65 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 90.9 p -48.45 -36.76 15.64 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -78.47 -45.93 20.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.556 0.616 . . . . 0.0 109.595 178.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.544 ' OG1' HG21 ' B' ' 131' ' ' THR . 20.9 m -64.0 -50.02 70.18 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.65 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.72 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 2.6 mmt -50.96 -43.13 60.33 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.849 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.448 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -61.21 -48.92 79.27 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -47.47 85.4 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.861 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -64.75 -38.63 91.64 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.57 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.598 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.11 -47.27 85.87 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -51.91 67.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 . . . . . 0 N--CA 1.449 -0.508 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.925 -179.551 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 9' ' ' VAL . 5.3 mmpt? . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 120.434 0.159 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 9' ' ' VAL . 26.9 tp60 -114.01 115.25 27.32 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.942 0.401 . . . . 0.0 111.887 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.428 ' NH1' ' HG3' ' B' ' 104' ' ' ARG . 5.9 ttm-85 -78.42 109.18 12.35 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.876 0.846 . . . . 0.0 111.773 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.81 HD11 HG11 ' B' ' 128' ' ' VAL . 0.8 OUTLIER -108.16 127.31 64.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 113.993 -1.458 . . . . 0.0 107.115 177.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.645 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.46 129.86 41.73 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -177.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.896 HG12 HD13 ' A' ' 24' ' ' ILE . 1.1 m -101.57 99.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 173.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.889 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -70.76 67.48 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.793 -0.763 . . . . 0.0 111.782 -177.695 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.851 HG22 HG22 ' B' ' 107' ' ' VAL . 3.8 m -99.67 -114.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 10.0 t0 145.74 -84.82 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -88.19 2.84 51.3 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.134 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.65 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -76.14 62.26 1.68 Allowed 'General case' 0 C--N 1.357 0.93 0 CA-C-N 119.588 1.085 . . . . 0.0 108.73 179.419 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.653 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 59.55 -25.58 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.813 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -44.49 -62.19 1.27 Allowed 'General case' 0 C--N 1.348 0.534 0 C-N-CA 123.352 0.661 . . . . 0.0 111.411 -179.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.576 ' N ' ' CG ' ' B' ' 114' ' ' TYR . 2.6 pp0? -49.45 -33.59 14.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.58 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.598 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -60.4 -50.18 74.61 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.861 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -52.53 -51.97 57.05 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.695 0.759 . . . . 0.0 111.557 -179.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.683 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -73.47 -29.02 62.26 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.193 179.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.54 -25.72 68.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.607 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.836 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -87.78 -41.0 13.59 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 118.608 -0.711 . . . . 0.0 109.804 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 158.68 39.04 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 177.057 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.635 ' O ' HG13 ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.1 94.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.885 ' O ' HD12 ' B' ' 124' ' ' ILE . 59.1 m-80 -67.3 71.01 0.11 Allowed 'General case' 0 N--CA 1.462 0.128 0 O-C-N 121.599 -0.688 . . . . 0.0 109.584 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.885 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.3 OUTLIER 37.59 -10.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.877 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.84 -55.99 1.14 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 120.002 1.274 . . . . 0.0 110.52 -176.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.547 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.16 -30.42 28.31 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.311 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.753 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.7 tm? -60.88 -61.26 2.71 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.952 0.376 . . . . 0.0 110.687 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.811 HG23 ' CG2' ' B' ' 124' ' ' ILE . 41.4 t -50.68 -64.19 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.713 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 24.7 p -50.42 -48.7 56.08 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -62.92 -50.92 68.94 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.544 HG21 ' OG1' ' A' ' 31' ' ' THR . 23.4 m -58.01 -42.69 85.78 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.06 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.919 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -59.19 -57.26 13.82 Favored 'General case' 0 C--O 1.209 -1.071 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.403 179.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.9 OUTLIER -49.1 -41.67 36.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.606 179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -51.91 54.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.602 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.864 ' HB3' HD21 ' A' ' 17' ' ' LEU . 8.9 tp10 -74.73 -14.57 60.74 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.684 0.278 . . . . 0.0 110.613 178.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.81 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.63 -38.02 16.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 123.211 0.604 . . . . 0.0 110.994 179.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -71.84 -53.45 13.24 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.835 0.826 . . . . 0.0 110.312 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.524 ' HD3' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.046 0 CA-C-N 113.969 -1.469 . . . . 0.0 113.62 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.594 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 20.7 mmtm . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.655 0.264 . . . . 0.0 110.746 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.654 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -112.85 114.54 27.11 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 120.927 0.394 . . . . 0.0 111.449 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.9 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.49 104.67 10.26 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.156 -0.618 . . . . 0.0 110.824 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.86 HD13 ' CD1' ' B' ' 114' ' ' TYR . 1.4 pt -109.41 127.92 65.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.869 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.9 141.74 48.54 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 117.955 -1.498 . . . . 0.0 113.316 -178.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 1.049 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.41 102.39 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.525 -1.216 . . . . 0.0 109.16 177.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.956 HG23 HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -70.18 76.92 0.52 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.815 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.2 p -110.67 -128.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.907 -176.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.808 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 5.3 t70 94.76 23.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 122.841 1.305 . . . . 0.0 109.399 -175.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 9' ' ' VAL . 12.3 t -150.24 -50.47 0.13 Allowed 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 112.746 -2.025 . . . . 0.0 110.486 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.715 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 5.6 m-20 -79.16 46.3 0.7 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.465 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 68.9 m 66.82 9.77 7.03 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.815 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -60.75 -50.74 72.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.969 1.258 . . . . 0.0 111.001 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 14.3 mm-40 -48.95 -32.46 9.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.735 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -64.81 -56.49 13.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.277 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.768 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.29 -56.08 8.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.275 0.559 . . . . 0.0 112.187 -178.306 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 15' ' ' GLN . 5.1 pttp -69.21 -25.98 64.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.491 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.13 -26.74 65.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.07 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.729 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.54 -38.57 15.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.725 -0.655 . . . . 0.0 109.664 178.812 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 156.69 25.04 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 177.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 24' ' ' ILE . 54.4 t -147.89 82.87 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 3.0 m-20 -64.65 63.79 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.939 0.4 . . . . 0.0 110.593 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.987 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 40.96 -13.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 23' ' ' ASN . 10.1 t -38.25 -61.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 119.862 1.21 . . . . 0.0 110.337 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -78.89 -36.13 29.38 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.031 178.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.546 HD13 HD11 ' A' ' 17' ' ' LEU . 7.9 tp -56.58 -61.87 2.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.766 0.317 . . . . 0.0 110.183 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.119 HG22 HG22 ' B' ' 128' ' ' VAL . 2.7 t -50.21 -64.52 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.176 178.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.685 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 26.5 p -49.36 -45.34 45.69 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -70.06 -42.94 72.17 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.583 HG21 ' OG1' ' B' ' 131' ' ' THR . 35.2 m -61.49 -42.78 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.038 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.853 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.4 mmt -50.27 -50.67 49.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.505 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.42 -45.15 95.52 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.145 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.505 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.74 -52.59 59.79 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.722 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 1.044 ' HG2' HD11 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -61.61 -37.1 82.7 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.154 178.714 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.852 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -66.23 -38.94 89.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.704 178.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -73.2 -56.1 5.56 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.397 0.618 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.89 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.183 -177.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 120.557 0.218 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.808 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 2.9 tt0 -122.49 119.88 32.24 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.076 0.465 . . . . 0.0 111.725 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.956 HH11 HG23 ' A' ' 8' ' ' THR . 9.9 ttt85 -79.64 117.95 21.02 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.795 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.831 HD11 HG11 ' B' ' 128' ' ' VAL . 0.5 OUTLIER -111.07 116.64 53.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.741 -179.656 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.869 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.11 126.06 54.21 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -176.26 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 107' ' ' VAL . 0.2 OUTLIER -100.86 85.78 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 175.425 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.9 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -56.03 98.39 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -179.655 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.998 HG11 ' CB ' ' B' ' 114' ' ' TYR . 14.9 p -110.36 -137.75 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.562 -175.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.747 ' H ' HG22 ' B' ' 109' ' ' VAL . 31.1 t70 89.14 -7.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -174.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.61 -65.51 1.14 Allowed 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.313 -1.312 . . . . 0.0 107.912 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.685 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -38.72 -84.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.244 0.34 . . . . 0.0 111.26 179.621 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.3 OUTLIER 173.9 45.86 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 121.123 0.487 . . . . 0.0 110.937 179.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.998 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.7 OUTLIER -83.35 -40.86 18.89 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.623 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.82 -40.59 21.54 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.852 HD22 ' HB1' ' A' ' 36' ' ' ALA . 1.4 mt -50.33 -33.48 20.38 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -78.4 -51.11 10.54 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.522 0.677 . . . . 0.0 111.648 178.705 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.623 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -70.46 -25.88 63.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.45 -27.85 50.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.019 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.542 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 2.8 m-30 -88.47 -40.75 13.23 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.303 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.3 t0 115.31 57.74 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.155 0.978 . . . . 0.0 111.547 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' B' ' 124' ' ' ILE . 92.0 t -118.34 -19.86 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.043 -179.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.612 ' O ' HD12 ' B' ' 124' ' ' ILE . 36.0 m-20 41.38 23.25 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.799 0.333 . . . . 0.0 111.562 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.874 HG22 HD22 ' B' ' 127' ' ' LEU . 2.4 pp 21.99 45.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 177.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.766 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 p -62.97 -63.72 1.12 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.813 176.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.443 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -81.15 -16.56 74.11 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.769 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 1.044 HD11 ' HG2' ' A' ' 35' ' ' GLU . 1.9 tp -66.82 -52.91 38.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.73 0.265 . . . . 0.0 111.235 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.119 HG22 HG22 ' A' ' 28' ' ' VAL . 35.0 t -53.57 -67.69 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.719 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.6 p -50.8 -36.64 38.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -63.06 -51.68 65.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.583 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.8 m -58.22 -31.73 67.63 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.081 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 14' ' ' TYR . 5.4 mmt -65.54 -54.71 24.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.482 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -49.94 -41.53 46.56 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.19 -54.0 44.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 116.833 -0.167 . . . . 0.0 110.749 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.1 mt-10 -75.08 -8.84 57.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.551 178.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -79.47 -47.31 15.85 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.224 -1.399 . . . . 0.0 107.224 176.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.9 74.54 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.398 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 . . . . . 0 CA--C 1.542 0.651 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.219 -178.582 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 121.093 0.473 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' B' ' 109' ' ' VAL . 1.2 tt0 -95.89 106.56 18.72 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.446 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.892 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.7 OUTLIER -78.87 99.86 6.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.738 -179.486 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.806 ' CG1' HD11 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -102.96 110.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 177.426 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.77 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.5 123.65 47.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 -175.645 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.647 HG22 ' CG2' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -100.16 105.66 17.96 Favored 'Isoleucine or valine' 0 C--N 1.344 0.337 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 176.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.0 p -70.08 90.46 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.028 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.1 t -78.08 -125.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.754 -177.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.585 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.6 t70 86.28 -5.34 0.76 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.292 0.568 . . . . 0.0 110.316 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.8 t -144.92 -52.0 0.28 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.335 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.794 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -44.78 -90.89 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.623 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' B' ' 129' ' ' SER . 1.6 m 177.85 34.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.392 -0.818 . . . . 0.0 111.133 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.028 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -84.05 -46.1 12.36 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.032 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.569 ' HA ' ' HG2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.12 -42.28 28.79 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.977 -176.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.89 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -60.29 -57.92 10.73 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.556 0.616 . . . . 0.0 111.82 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.093 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -60.34 -35.76 76.4 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.633 -178.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.784 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.74 -32.13 41.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.373 0.606 . . . . 0.0 112.117 -179.522 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.616 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -82.1 -16.88 48.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.267 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.737 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.98 -33.32 18.45 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.212 179.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.573 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 172.88 -19.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.784 ' O ' ' HA ' ' A' ' 18' ' ' LYS . 17.0 t -97.19 -179.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.255 0.55 . . . . 0.0 110.168 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.053 ' O ' HD12 ' A' ' 24' ' ' ILE . 20.8 m120 -160.67 43.94 0.19 Allowed 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 177.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.053 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.96 -4.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 113.022 -1.899 . . . . 0.0 115.921 -177.45 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.49 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.4 t -39.02 -63.79 0.5 Allowed 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.09 0.859 . . . . 0.0 109.675 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.587 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -86.76 -25.36 35.39 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.941 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.821 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -59.49 -62.36 1.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.438 0.619 . . . . 0.0 110.279 179.623 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.797 HG22 HG21 ' B' ' 124' ' ' ILE . 16.2 t -50.59 -59.26 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.787 0.804 . . . . 0.0 109.383 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 1.4 t -50.12 -52.58 33.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.0 OUTLIER -74.14 -50.96 17.12 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 117.762 0.255 . . . . 0.0 110.435 -177.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.579 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -54.17 -49.16 69.93 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.916 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.917 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 14.9 mtt -54.77 -48.16 73.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.189 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -45.35 73.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.413 0.149 . . . . 0.0 110.778 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -61.93 -57.1 13.03 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.7 OUTLIER -58.27 -33.61 69.6 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.692 178.449 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.626 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -70.41 -48.81 54.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.519 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -52.63 64.78 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.369 0.604 . . . . 0.0 111.135 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.698 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.918 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.547 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 18.4 mttm . . . . . 0 CA--C 1.534 0.364 0 CA-C-O 120.603 0.24 . . . . 0.0 111.637 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.585 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 43.5 tp60 -124.45 123.41 40.1 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.653 0.263 . . . . 0.0 110.99 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 5.8 ttm105 -85.92 116.45 24.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.354 0.597 . . . . 0.0 111.949 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.739 HD11 HG11 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -114.45 125.78 71.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 177.296 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.77 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.04 125.72 33.99 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.373 -0.531 . . . . 0.0 112.354 -176.728 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.62 HG12 ' CG2' ' B' ' 109' ' ' VAL . 0.9 OUTLIER -102.65 98.46 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 175.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.892 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.5 p -70.27 93.42 0.84 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.523 0.678 . . . . 0.0 110.816 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.098 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.9 t -85.55 -141.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.008 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.0 t0 91.01 -9.69 0.28 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 5.2 m -129.03 -56.63 1.18 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.196 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 1.2 m-20 -54.68 -104.19 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -167.14 29.24 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.018 -1.051 . . . . 0.0 111.661 -179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.098 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -72.73 -38.7 67.35 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.647 1.179 . . . . 0.0 112.864 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.642 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.99 -42.27 37.29 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -175.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.626 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -56.37 -34.55 66.76 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.35 0.977 . . . . 0.0 112.857 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.917 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -70.93 -52.36 20.42 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.97 0.414 . . . . 0.0 110.68 179.528 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.86 -25.69 66.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.446 0.641 . . . . 0.0 109.467 177.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.08 -33.25 75.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.957 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.707 ' CZ ' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.99 -29.03 21.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.925 -0.56 . . . . 0.0 110.446 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.0 t0 123.58 71.26 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.751 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -169.39 -40.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.506 ' O ' ' HE1' ' A' ' 32' ' ' MET . 14.8 m-80 64.47 -106.95 0.16 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.037 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.09 1.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 178.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.3 OUTLIER -39.47 -63.76 0.53 Allowed 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.721 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.462 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.38 -29.88 23.57 Favored Glycine 0 CA--C 1.522 0.515 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.945 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.702 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -56.88 -60.53 3.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.453 0.301 . . . . 0.0 110.813 179.187 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.037 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -53.55 -64.86 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.794 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 12.8 p -49.21 -43.96 42.84 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.8 m -72.18 -48.8 40.57 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.23 -36.87 85.07 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.025 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.093 ' HA ' HD12 ' A' ' 17' ' ' LEU . 3.7 mmt -64.42 -54.64 29.56 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.946 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.498 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -48.47 -35.67 13.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.806 -179.595 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -66.35 -57.26 7.83 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.774 ' CB ' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -73.08 -13.05 61.12 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.478 0.18 . . . . 0.0 111.189 178.626 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.89 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.84 -30.3 20.29 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 121.086 0.47 . . . . 0.0 109.807 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -82.29 -48.26 11.42 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.71 0.767 . . . . 0.0 110.686 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.674 0 CA-C-N 114.028 -1.442 . . . . 0.0 114.095 -177.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' B' ' 108' ' ' THR . 60.8 tp60 -108.79 111.15 22.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.311 0.577 . . . . 0.0 112.095 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.0 ttm-85 -79.36 103.6 9.4 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.64 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.811 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -98.1 130.34 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.066 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.076 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.794 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -131.32 130.07 42.27 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 117.799 -1.561 . . . . 0.0 114.191 -177.745 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 1.044 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -100.63 108.05 22.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.191 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.076 177.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.16 87.5 0.79 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.806 0.813 . . . . 0.0 109.477 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.074 HG21 ' CD2' ' A' ' 14' ' ' TYR . 4.7 m -71.43 -155.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.271 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.668 ' CB ' ' HA ' ' B' ' 102' ' ' LYS . 22.3 t70 91.24 -19.04 0.14 Allowed 'General case' 0 C--N 1.35 0.626 0 C-N-CA 123.689 0.795 . . . . 0.0 109.783 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.3 m -110.26 -69.6 0.86 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.852 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.647 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -51.69 -88.71 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.579 ' O ' ' HB2' ' B' ' 132' ' ' MET . 1.3 m 175.29 46.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.323 0.965 . . . . 0.0 111.874 -178.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.074 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.44 -44.72 15.69 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -179.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 61.5 mt-30 -47.99 -38.43 16.96 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -175.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.876 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.0 OUTLIER -61.38 -57.38 12.51 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.746 0.703 . . . . 0.0 112.669 -179.718 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.79 ' CB ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -47.31 -48.84 25.04 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.431 0.634 . . . . 0.0 112.128 -178.053 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.621 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 2.9 pttt -78.98 -29.39 43.79 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.262 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.94 -27.46 68.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.715 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.643 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.33 -43.06 11.8 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.667 -0.683 . . . . 0.0 110.445 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.5 t70 168.98 15.3 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.55 HG11 HD13 ' A' ' 27' ' ' LEU . 65.7 t -142.4 84.75 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -177.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.01 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -71.77 51.47 0.2 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.206 0.526 . . . . 0.0 110.852 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.143 HD11 HD12 ' B' ' 105' ' ' ILE . 0.9 OUTLIER 40.9 -8.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 118.97 2.952 . . . . 0.0 118.97 179.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.486 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -38.52 -63.24 0.52 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-N 119.99 1.268 . . . . 0.0 110.439 -179.022 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.1 -28.44 34.08 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.549 178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.64 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 11.3 tp -63.3 -62.19 1.85 Allowed 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.717 0.259 . . . . 0.0 110.692 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.005 HG22 HG22 ' B' ' 128' ' ' VAL . 2.3 t -45.65 -64.61 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 O-C-N 123.373 0.421 . . . . 0.0 110.426 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.648 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 4.8 p -49.18 -35.26 16.51 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 123.136 0.273 . . . . 0.0 111.57 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 19.4 m -69.95 -52.15 26.82 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.503 ' CG2' HD11 ' B' ' 127' ' ' LEU . 86.0 m -55.89 -39.02 70.95 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.293 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.909 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.3 OUTLIER -54.84 -55.51 29.54 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.695 179.198 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -44.87 87.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.103 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.1 -50.82 62.75 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.184 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.763 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.64 -33.88 76.91 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.137 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.703 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -61.28 -45.09 95.93 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.77 -51.94 55.03 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.839 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.544 0 CA-C-N 114.055 -1.429 . . . . 0.0 113.531 -177.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.668 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 10.0 mmtt . . . . . 0 N--CA 1.467 0.378 0 CA-C-O 120.562 0.22 . . . . 0.0 111.267 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.871 ' O ' HG22 ' A' ' 9' ' ' VAL . 16.6 tp60 -121.19 125.8 48.08 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 121.66 0.743 . . . . 0.0 111.609 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.427 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 1.7 ttm180 -83.81 116.62 22.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.317 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.143 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -94.53 123.48 46.66 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.313 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.659 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -131.07 111.93 12.44 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.482 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.811 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.56 98.25 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 175.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.976 HG22 ' HG3' ' A' ' 4' ' ' ARG . 72.1 p -68.25 93.44 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.842 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.067 HG21 ' CB ' ' B' ' 114' ' ' TYR . 6.3 t -80.57 -125.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.143 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.688 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.6 t70 83.21 -15.22 0.66 Allowed 'General case' 0 C--N 1.349 0.557 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -176.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.11 -59.25 1.42 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.997 177.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.66 ' HB2' HG13 ' B' ' 109' ' ' VAL . 1.2 m-20 -46.24 -98.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' MET . 24.9 t -175.6 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.461 -0.774 . . . . 0.0 110.504 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.067 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -81.63 -46.58 14.17 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.014 0.926 . . . . 0.0 113.406 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.94 -40.78 31.54 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.797 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.703 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -53.66 -25.35 17.66 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.661 0.664 . . . . 0.0 112.385 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.11 -60.43 2.37 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.711 0.767 . . . . 0.0 110.269 178.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.7 pttt -62.4 -25.11 67.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.19 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.64 -23.93 19.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.18 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.593 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 65.9 m-85 -87.52 -50.98 6.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 24.0 t0 136.83 54.52 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 O-C-N 124.726 1.266 . . . . 0.0 109.913 179.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.625 ' CG1' HD13 ' B' ' 117' ' ' LEU . 7.1 p -154.1 87.1 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.095 -178.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.948 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -70.55 52.9 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.948 HD12 ' O ' ' B' ' 123' ' ' ASN . 1.3 pp 29.08 10.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 119.433 3.123 . . . . 0.0 119.433 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 1.044 ' HA ' HG22 ' A' ' 7' ' ' VAL . 3.2 p -37.24 -60.91 0.62 Allowed 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 122.765 0.426 . . . . 0.0 110.891 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.725 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.95 -19.55 61.05 Favored Glycine 0 C--O 1.222 -0.644 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.279 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.725 HD12 ' CG2' ' B' ' 124' ' ' ILE . 2.7 tm? -67.36 -56.44 9.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 117.151 0.476 . . . . 0.0 110.745 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.005 HG22 HG22 ' A' ' 28' ' ' VAL . 95.5 t -59.06 -68.65 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 120.951 0.405 . . . . 0.0 110.157 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.647 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 56.3 p -50.32 -38.24 40.66 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.725 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -82.57 -50.02 9.25 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.177 1.353 . . . . 0.0 111.413 -179.286 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -51.43 -31.44 22.97 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.973 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.79 ' SD ' ' CB ' ' A' ' 17' ' ' LEU . 2.1 mmt -61.3 -50.57 72.44 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.227 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.573 ' CB ' ' CB ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -49.94 -40.32 43.24 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.518 0.599 . . . . 0.0 111.171 179.4 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -68.18 -49.41 61.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.773 ' HB2' HD21 ' A' ' 17' ' ' LEU . 4.3 mm-40 -77.28 -18.94 57.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.862 0.363 . . . . 0.0 110.532 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.876 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -75.21 -34.97 61.53 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -56.14 4.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 121.785 0.802 . . . . 0.0 109.516 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.915 0 CA-C-N 114.016 -1.447 . . . . 0.0 114.781 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.514 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 5.2 mtmt . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.581 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.682 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 20.1 tp60 -118.46 113.78 21.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.029 0.442 . . . . 0.0 111.08 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.797 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.96 107.98 13.17 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.746 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.992 HD13 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -112.78 128.05 69.69 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.779 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -127.87 136.26 51.16 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.53 -177.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 1.063 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.65 106.89 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.326 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 3.2 p -70.37 91.74 0.77 Allowed 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.721 -0.392 . . . . 0.0 109.957 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.979 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.3 t -85.39 -139.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.112 -178.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.549 ' H ' HG12 ' A' ' 9' ' ' VAL . 24.8 t0 92.32 -10.4 0.2 Allowed 'General case' 0 C--N 1.35 0.606 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -175.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 m -129.67 -54.06 1.15 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.06 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.82 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -48.1 -99.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.505 ' N ' ' HB2' ' B' ' 129' ' ' SER . 0.2 OUTLIER -176.28 37.64 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.32 -0.863 . . . . 0.0 110.734 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.979 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.75 -35.27 26.76 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.368 1.067 . . . . 0.0 113.786 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.518 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.95 -46.25 43.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.679 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -50.64 -33.32 21.9 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.9 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 2.2 mt -74.52 -60.07 2.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.361 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.98 -26.29 68.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.716 0.77 . . . . 0.0 109.815 178.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -31.61 72.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.883 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.684 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.24 -38.73 15.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.331 179.491 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.684 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 29.8 t70 146.83 31.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.552 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 54.6 t -161.61 99.85 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 O-C-N 122.254 -0.279 . . . . 0.0 111.071 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.523 ' O ' ' HE1' ' B' ' 132' ' ' MET . 42.3 m-80 -54.3 -88.34 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.896 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -161.4 7.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.5 p -38.72 -62.74 0.58 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.551 0.614 . . . . 0.0 110.748 -177.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.4 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -84.18 -30.52 28.0 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.722 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.896 ' HB3' HG22 ' A' ' 24' ' ' ILE . 1.1 tm? -59.8 -59.91 4.68 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.782 0.291 . . . . 0.0 110.769 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.884 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -49.71 -65.4 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.902 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -49.22 -41.06 36.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.3 m -67.69 -54.08 22.43 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -40.01 94.16 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.088 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.812 ' SD ' ' CB ' ' B' ' 117' ' ' LEU . 3.5 mmt -57.97 -58.05 10.1 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.677 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.637 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.1 OUTLIER -51.86 -37.91 53.97 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.118 0.417 . . . . 0.0 111.398 179.804 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.04 -55.38 7.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.813 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -21.47 64.8 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.047 0.451 . . . . 0.0 109.81 178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -73.44 -49.18 28.26 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -51.12 69.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.769 0.795 . . . . 0.0 109.324 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.741 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.173 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 9.3 mmtm . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 121.003 0.43 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.717 ' OE1' HG22 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -95.98 114.88 26.64 Favored 'General case' 0 CA--C 1.495 -1.157 0 CA-C-O 121.094 0.473 . . . . 0.0 111.979 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.7 ' CZ ' HG21 ' A' ' 6' ' ' THR . 7.4 ttt-85 -79.31 98.97 6.89 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.658 -0.817 . . . . 0.0 108.998 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.717 HG22 ' OE1' ' B' ' 103' ' ' GLN . 0.3 OUTLIER -99.02 110.69 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.779 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -116.25 120.4 38.84 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.127 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.992 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.19 109.56 25.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 174.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.797 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.1 p -70.28 80.38 0.53 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.932 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.4 p -87.97 -140.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.358 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.702 ' H ' HG22 ' B' ' 109' ' ' VAL . 3.3 t70 86.44 -3.9 0.72 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 122.103 0.954 . . . . 0.0 108.854 -175.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.32 -64.91 1.09 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.152 177.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.799 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -44.48 -85.85 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.038 -179.212 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.637 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 2.2 m 176.38 39.51 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 119.011 0.823 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.932 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.58 -43.22 15.91 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.621 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.8 OUTLIER -47.65 -39.26 16.65 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -174.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.811 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.7 -56.04 26.78 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.444 1.02 . . . . 0.0 111.734 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.812 ' CB ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -52.11 -43.56 64.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.998 -178.326 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.621 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -79.26 -31.97 43.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.492 179.007 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -57.3 -30.21 64.55 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.493 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.713 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.45 -46.26 9.28 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 118.366 -0.826 . . . . 0.0 109.731 178.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.657 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 155.95 32.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.542 HG12 ' O ' ' B' ' 122' ' ' VAL . 46.4 t -145.88 84.53 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.041 ' O ' HD12 ' B' ' 124' ' ' ILE . 53.4 m-80 -68.95 61.22 0.1 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.076 0.465 . . . . 0.0 110.887 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.063 HD13 HG12 ' A' ' 7' ' ' VAL . 0.7 OUTLIER 42.57 -6.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -179.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.486 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.88 -62.86 0.58 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.789 1.177 . . . . 0.0 110.274 -179.008 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.05 -29.7 24.96 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.482 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.723 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -59.22 -61.16 2.84 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.827 0.451 . . . . 0.0 110.233 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.979 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -49.64 -59.23 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.563 179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.0 p -50.0 -39.77 42.36 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 52.2 m -70.14 -50.35 41.36 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 6.8 m -61.63 -43.73 98.31 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.086 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.9 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 7.0 mtt -59.54 -57.5 12.68 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.104 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -42.86 71.31 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.163 0.289 . . . . 0.0 111.393 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -66.76 -53.08 36.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.561 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -64.07 -32.67 74.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.679 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -68.05 -50.9 52.41 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.272 0.629 . . . . 0.0 111.18 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -52.39 63.83 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 . . . . . 0 CA--C 1.541 0.606 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.458 179.307 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.539 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 44.2 tp60 -123.67 118.44 27.26 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.372 0.606 . . . . 0.0 112.057 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.04 115.28 18.61 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.308 179.191 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.718 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -110.18 123.24 65.91 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.31 126.03 34.29 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.579 -177.017 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.799 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -102.13 107.15 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 3.5 p -70.86 89.38 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.143 0.497 . . . . 0.0 110.864 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.182 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.9 m -83.25 -150.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.808 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.569 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 25.5 t0 94.82 -7.87 0.11 Allowed 'General case' 0 C--N 1.348 0.519 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -127.98 -59.6 1.18 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.466 -1.243 . . . . 0.0 108.854 176.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.16 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.419 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.4 OUTLIER -175.41 38.35 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.288 0.949 . . . . 0.0 111.107 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.182 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.98 -44.88 16.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.171 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.581 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 13.1 mt-30 -49.24 -43.72 42.97 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.658 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -53.25 -30.97 41.19 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 118.589 0.632 . . . . 0.0 112.132 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.966 ' CD1' HD22 ' A' ' 27' ' ' LEU . 1.7 mt -77.78 -51.77 9.99 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.988 0.423 . . . . 0.0 111.69 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.668 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -65.79 -25.35 67.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.411 0.624 . . . . 0.0 110.199 178.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.55 -31.02 55.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.747 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.57 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 46.1 m-85 -88.63 -39.82 13.78 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.22 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.2 t70 118.33 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.474 1.13 . . . . 0.0 110.149 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.546 ' HB ' HD22 ' A' ' 17' ' ' LEU . 64.6 t -130.59 -47.5 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.156 0 CA-C-N 113.979 -1.464 . . . . 0.0 109.46 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.598 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.8 m120 58.3 -113.86 0.73 Allowed 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.111 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.959 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.0 -0.45 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 115.872 1.805 . . . . 0.0 115.872 -179.556 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 24' ' ' ILE . 9.2 t -39.78 -64.44 0.49 Allowed 'General case' 0 C--O 1.24 0.59 0 C-N-CA 119.575 -0.85 . . . . 0.0 109.968 -178.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.534 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -81.45 -27.06 49.39 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.245 178.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.966 HD22 ' CD1' ' A' ' 17' ' ' LEU . 5.3 tp -62.5 -61.52 2.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.768 0.284 . . . . 0.0 111.008 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.823 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.7 t -51.83 -70.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.755 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 38.5 p -47.68 -42.53 25.02 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.534 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -74.57 -45.64 44.08 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 119.032 0.833 . . . . 0.0 109.778 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.571 HG23 HD11 ' B' ' 127' ' ' LEU . 0.5 OUTLIER -68.47 -27.92 66.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.568 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.887 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.5 mmt -57.08 -55.63 32.22 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.368 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.47 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.63 -53.34 53.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.03 0.443 . . . . 0.0 110.42 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.47 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 1.9 m-20 -57.28 -50.83 71.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.049 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HG3' HD21 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -68.43 -30.27 69.11 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.13 0.491 . . . . 0.0 109.874 177.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.73 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -67.04 -43.26 83.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.065 0.459 . . . . 0.0 110.374 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -78.91 -54.67 5.82 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.273 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 tpp180 . . . . . 0 N--CA 1.444 -0.741 0 CA-C-N 114.662 -1.154 . . . . 0.0 114.039 -176.462 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.503 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.563 0 CA-C-O 120.843 0.354 . . . . 0.0 111.064 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.536 ' HB3' HG23 ' A' ' 9' ' ' VAL . 7.8 tt0 -107.03 109.17 20.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.348 0.594 . . . . 0.0 111.45 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 5.7 ttm180 -78.54 104.82 9.39 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.787 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.86 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.3 pt -104.94 126.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -130.58 124.54 32.01 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 119.618 -0.833 . . . . 0.0 112.859 -177.608 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.884 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.94 103.95 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 173.973 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.839 HG22 ' HG3' ' A' ' 4' ' ' ARG . 15.9 p -66.24 93.06 0.2 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.921 0.391 . . . . 0.0 110.673 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' HB2' ' B' ' 114' ' ' TYR . 1.4 t -96.49 -135.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.596 -178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.539 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 5.4 t70 101.06 12.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 122.623 1.201 . . . . 0.0 108.615 -175.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.569 ' H ' HG12 ' B' ' 109' ' ' VAL . 44.8 m -159.65 -48.23 0.05 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.065 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.755 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -69.59 50.62 0.1 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 32' ' ' MET . 0.1 OUTLIER 57.9 3.05 0.2 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 177.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.936 ' HB2' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -59.08 -56.48 21.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 118.377 0.535 . . . . 0.0 111.817 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.567 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 28.6 mt-30 -48.84 -35.95 15.79 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.73 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -53.69 -43.88 69.28 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.418 0.554 . . . . 0.0 111.218 179.61 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.887 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.3 mt -65.47 -55.38 18.27 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.681 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -66.8 -25.49 66.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.96 179.778 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.476 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.36 -25.28 23.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.919 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.713 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.3 m-30 -88.12 -51.24 5.9 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.9 OUTLIER 132.53 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 O-C-N 125.069 1.481 . . . . 0.0 110.996 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.85 ' CG1' HD22 ' B' ' 117' ' ' LEU . 7.8 p -142.72 -39.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.658 ' O ' HD13 ' B' ' 117' ' ' LEU . 28.9 m-80 61.63 -120.96 0.75 Allowed 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.065 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.48 6.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -39.77 -63.92 0.54 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.13 0.491 . . . . 0.0 110.369 -178.253 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.55 -27.66 26.61 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.167 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -61.99 -62.22 1.94 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.44 0.296 . . . . 0.0 110.789 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.065 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -50.29 -59.27 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.783 178.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.716 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.5 p -50.39 -38.0 40.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 99.5 m -72.23 -55.6 6.95 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.464 HG22 HD21 ' A' ' 27' ' ' LEU . 54.5 m -56.52 -40.28 74.77 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.261 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.947 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -54.17 -56.12 21.27 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.731 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -58.33 -37.68 75.61 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.07 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -29.01 69.29 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.658 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -65.35 -47.75 75.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.95 0.405 . . . . 0.0 110.273 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -72.76 -50.98 21.01 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.738 0.78 . . . . 0.0 110.386 178.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.434 ' CZ ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.638 0 CA-C-N 114.078 -1.419 . . . . 0.0 113.78 -177.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 1.5 mmtt . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 121.188 0.518 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' B' ' 108' ' ' THR . 13.5 tp60 -95.36 121.56 37.15 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.023 ' HG3' HG22 ' B' ' 108' ' ' THR . 1.0 OUTLIER -77.68 102.95 7.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 121.499 0.666 . . . . 0.0 111.573 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.78 HD11 HG11 ' A' ' 28' ' ' VAL . 1.1 pt -100.79 111.57 30.88 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.567 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.54 120.48 38.87 Favored 'General case' 0 C--N 1.313 -1.02 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.846 -176.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.758 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.43 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.31 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.9 OUTLIER -68.06 79.94 0.22 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 -178.578 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.032 HG21 ' CD2' ' A' ' 14' ' ' TYR . 18.6 m -75.54 -145.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.701 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.94 -12.61 0.33 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.0 m -118.72 -62.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.09 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.875 ' HB2' ' CB ' ' B' ' 129' ' ' SER . 1.3 p30 -47.5 -91.84 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -175.87 41.19 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.423 -0.798 . . . . 0.0 111.342 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.088 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -79.16 -41.8 27.63 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.588 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.59 -46.33 39.2 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -176.718 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.874 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -47.92 -33.88 8.26 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.598 0.713 . . . . 0.0 112.304 179.547 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.978 HD13 HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -77.4 -60.48 2.35 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.705 179.577 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.588 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -59.41 -25.65 64.49 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.308 179.51 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -59.12 -31.32 68.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.232 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.863 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -93.78 -27.95 16.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.565 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 27.5 t70 121.46 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.133 0.973 . . . . 0.0 110.812 176.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.978 HG13 HD13 ' A' ' 17' ' ' LEU . 8.5 p -150.25 77.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.565 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.966 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -73.54 51.98 0.37 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 0.0 111.935 -179.898 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.002 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 40.75 -2.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 118.479 2.77 . . . . 0.0 118.479 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 23' ' ' ASN . 3.9 p -38.19 -62.96 0.52 Allowed 'General case' 0 C--O 1.24 0.587 0 CA-C-N 119.479 1.036 . . . . 0.0 110.378 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.424 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -85.64 -34.41 13.73 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.988 177.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.615 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -53.4 -61.34 2.36 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 120.825 0.345 . . . . 0.0 110.592 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.002 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -50.99 -68.24 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.473 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.635 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.4 m -50.09 -41.27 47.89 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 2.0 m -70.03 -51.63 30.6 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -56.12 -38.73 71.17 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.549 178.626 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.909 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.0 mtt -60.32 -56.17 24.68 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.82 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -48.85 -40.86 31.17 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.052 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -63.62 -57.06 11.27 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -10.09 59.21 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.093 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -87.0 -37.65 17.31 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -50.33 19.24 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.996 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.637 0 CA-C-N 113.948 -1.478 . . . . 0.0 111.876 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 8.4 mttm . . . . . 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.675 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -105.97 100.34 9.9 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.459 0.647 . . . . 0.0 110.86 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.682 ' NH2' HG21 ' B' ' 106' ' ' THR . 4.1 ttp180 -78.99 99.45 6.86 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.337 0.589 . . . . 0.0 110.632 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.088 HD13 ' CD1' ' A' ' 14' ' ' TYR . 21.8 pt -104.31 129.88 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.784 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 177.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.682 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.4 OUTLIER -131.35 125.83 33.68 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.428 -0.909 . . . . 0.0 112.84 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.763 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.8 98.29 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 1.023 HG22 ' HG3' ' A' ' 4' ' ' ARG . 68.1 p -66.87 95.79 0.39 Allowed 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.0 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.9 t -85.77 -128.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.915 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.599 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 24.0 t70 82.66 -12.56 0.89 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.923 0.783 . . . . 0.0 108.939 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -125.12 -61.44 1.29 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.01 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.804 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -44.4 -94.4 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.577 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.415 ' N ' ' HB3' ' A' ' 29' ' ' SER . 34.2 t 179.42 41.75 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.871 0.759 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.0 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.51 -45.32 13.72 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.649 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.5 mt-30 -48.89 -39.27 25.31 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -174.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.637 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -58.29 -52.62 64.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.239 0.927 . . . . 0.0 111.752 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.909 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -49.07 -49.97 38.97 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.432 0.634 . . . . 0.0 111.422 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.649 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 2.1 pttt -76.01 -29.25 58.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.474 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' B' ' 116' ' ' LEU . . . -64.12 -28.18 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.083 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.578 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -87.72 -42.75 12.41 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 118.819 -0.61 . . . . 0.0 109.699 178.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.578 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 155.89 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 176.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.508 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 76.0 t -154.19 91.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 121.816 -0.552 . . . . 0.0 111.777 -177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.571 ' HB2' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -57.51 -88.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 178.349 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.008 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -154.72 -0.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 115.864 1.801 . . . . 0.0 115.864 179.039 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 22.0 p -39.46 -63.16 0.59 Allowed 'General case' 0 C--O 1.241 0.62 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.563 -179.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.82 -30.11 24.5 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 121.293 -0.48 . . . . 0.0 112.214 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.676 ' HB3' HG22 ' B' ' 124' ' ' ILE . 5.8 tp -58.59 -61.03 2.9 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.776 0.288 . . . . 0.0 110.33 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.008 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.5 t -51.37 -64.63 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.012 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.875 ' CB ' ' HB2' ' A' ' 12' ' ' ASP . 7.8 p -48.41 -45.0 35.53 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -46.63 51.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 25.4 m -60.64 -37.9 83.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.917 178.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.85 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.79 -58.4 8.74 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.978 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -58.79 -36.06 73.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.888 -178.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -74.07 -49.51 23.73 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.529 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.756 ' HG3' HD21 ' A' ' 17' ' ' LEU . 21.6 tp10 -69.95 -20.24 63.34 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.874 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.36 -52.78 5.01 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 13.8 mtt180 -57.28 -56.62 19.5 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 121.503 0.668 . . . . 0.0 110.2 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.421 ' HD3' ' O ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.021 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.623 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' B' ' 109' ' ' VAL . 5.9 mmtm . . . . . 0 N--CA 1.467 0.4 0 CA-C-O 120.866 0.365 . . . . 0.0 110.872 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' B' ' 109' ' ' VAL . 1.7 tt0 -109.83 108.82 19.27 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.028 0.442 . . . . 0.0 110.235 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.803 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.1 ttm105 -79.63 110.15 14.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.969 . . . . 0.0 112.239 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.94 HD11 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -104.82 130.95 55.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 176.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.76 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -131.48 130.02 41.9 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.435 -1.306 . . . . 0.0 113.523 -177.213 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.898 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.51 98.21 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.619 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.501 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 1.2 p -71.08 67.42 0.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.581 0.705 . . . . 0.0 109.529 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 10' ' ' ASP . 7.1 p -88.83 -131.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-O 117.433 -1.27 . . . . 0.0 109.961 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 9' ' ' VAL . 32.3 t70 114.43 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 119.759 1.163 . . . . 0.0 110.975 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.475 ' H ' HG22 ' A' ' 9' ' ' VAL . 63.1 p 173.64 -27.29 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.524 -1.217 . . . . 0.0 113.379 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.741 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 33.0 m-20 -80.89 70.06 7.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.249 -0.981 . . . . 0.0 112.118 -177.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.542 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 34.5 m 57.46 -11.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 178.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.823 ' CE1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -56.84 -53.77 54.07 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.113 0.87 . . . . 0.0 109.868 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.2 mt-30 -49.35 -42.24 41.25 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.476 -178.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -53.63 -56.06 20.5 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.371 0.532 . . . . 0.0 111.843 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.787 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.06 -47.55 33.82 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.121 -179.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.782 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 22.8 pttt -79.42 -30.5 42.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.178 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -26.39 68.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.862 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.728 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.02 -43.94 11.35 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 118.636 -0.697 . . . . 0.0 109.481 178.418 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 154.49 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 176.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.449 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 74.4 t -157.93 90.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 CA-C-O 120.785 0.326 . . . . 0.0 110.642 -178.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.782 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -57.22 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.404 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.09 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -150.08 -2.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 179.866 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 24' ' ' ILE . 55.6 p -39.61 -65.01 0.42 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.896 -177.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.605 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.66 -24.33 50.33 Favored Glycine 0 C--O 1.228 -0.25 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.603 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -64.24 -62.27 1.72 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 122.482 0.313 . . . . 0.0 111.324 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.09 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.5 t -53.18 -62.74 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 O-C-N 123.02 0.2 . . . . 0.0 110.815 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.807 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 12.9 p -48.35 -40.04 24.15 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -75.7 -45.82 34.68 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.416 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.66 ' HB ' HD21 ' B' ' 127' ' ' LEU . 1.9 p -57.84 -45.01 86.86 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 178.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.131 ' HA ' HD12 ' B' ' 117' ' ' LEU . 4.0 mmt -57.5 -57.19 13.77 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.151 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.428 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -57.91 -39.83 78.89 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -63.65 -57.27 10.59 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.843 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.65 ' OE1' HD11 ' B' ' 117' ' ' LEU . 5.8 mt-10 -70.97 -14.49 62.38 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.825 178.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.812 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.22 -28.85 22.13 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 120.998 0.428 . . . . 0.0 110.822 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -49.84 10.9 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.974 0.893 . . . . 0.0 109.277 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.78 0 CA-C-N 113.884 -1.507 . . . . 0.0 112.554 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.202 0.525 . . . . 0.0 111.613 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.723 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.8 OUTLIER -111.04 108.29 17.97 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.526 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.858 ' NH2' HG21 ' B' ' 106' ' ' THR . 5.0 ttp180 -77.44 104.67 8.1 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.474 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.018 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -95.61 109.17 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.668 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.858 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -117.95 116.94 27.94 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 118.759 -1.176 . . . . 0.0 113.158 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.94 HG13 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -100.73 103.18 14.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.803 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 17.9 p -70.33 87.3 0.61 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.777 0.799 . . . . 0.0 110.249 -178.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.334 HG21 ' CD1' ' B' ' 114' ' ' TYR . 19.7 m -72.78 -137.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.912 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.671 ' N ' HG23 ' B' ' 109' ' ' VAL . 26.9 t0 92.3 -8.43 0.2 Allowed 'General case' 0 C--N 1.356 0.864 0 CA-C-O 121.458 0.646 . . . . 0.0 109.603 -177.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 6.1 t -136.47 -55.24 0.74 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.489 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.807 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -44.04 -94.25 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -177.625 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 32' ' ' MET . 0.1 OUTLIER 176.48 37.56 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.963 0.802 . . . . 0.0 110.939 -179.508 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.334 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.22 -43.97 15.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -179.293 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.732 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.2 mm100 -47.55 -37.46 12.3 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -174.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.812 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -64.32 -56.96 10.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.053 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 1.131 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -52.33 -41.42 62.98 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.255 -177.142 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.3 OUTLIER -79.38 -29.37 42.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.627 -179.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -64.38 -30.63 71.67 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.39 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.997 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.95 -40.47 13.02 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.499 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 22.2 t70 170.2 15.01 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.933 ' HB ' HD22 ' B' ' 117' ' ' LEU . 51.4 t -135.45 76.15 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 121.333 -0.854 . . . . 0.0 113.101 -177.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.115 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m120 -66.06 57.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.115 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.2 OUTLIER 50.99 -26.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.96 -64.22 0.42 Allowed 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.395 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.632 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.37 -20.77 53.92 Favored Glycine 0 C--O 1.227 -0.332 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.415 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.802 ' HG ' HD13 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.39 -60.35 4.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.998 HG23 HG22 ' B' ' 124' ' ' ILE . 74.8 t -54.1 -65.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.719 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.741 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 52.5 p -49.17 -46.95 46.14 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -75.41 -50.33 16.21 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 119.376 0.989 . . . . 0.0 110.358 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.662 ' HB ' HD22 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.12 -44.14 74.73 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.435 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.894 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.7 mmt -52.35 -45.66 65.78 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.203 178.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.542 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -52.93 -48.0 67.63 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.904 0.383 . . . . 0.0 111.535 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.7 -51.59 67.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -77.4 -9.29 58.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.977 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -88.05 -33.97 18.13 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -55.67 5.45 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 121.782 0.801 . . . . 0.0 109.354 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.517 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 4.6 mmp_? . . . . . 0 N--CA 1.442 -0.866 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.457 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.334 0 CA-C-O 120.658 0.266 . . . . 0.0 110.945 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.781 ' HB3' ' CB ' ' B' ' 110' ' ' ASP . 1.4 tp60 -114.55 129.11 56.64 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.762 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.89 ' NH2' HG21 ' A' ' 6' ' ' THR . 15.1 ttp85 -78.31 99.41 6.31 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.714 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.804 HG21 ' CG ' ' B' ' 114' ' ' TYR . 1.3 pt -94.61 113.86 30.01 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.236 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.713 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.89 HG21 ' NH2' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -119.6 122.69 42.14 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.092 -1.043 . . . . 0.0 112.581 -178.013 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.93 HG12 HG22 ' B' ' 105' ' ' ILE . 2.1 p -99.23 106.75 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 114.242 -1.345 . . . . 0.0 107.936 177.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.409 ' CG2' ' CZ ' ' B' ' 104' ' ' ARG . 0.7 OUTLIER -70.1 68.09 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.098 0.951 . . . . 0.0 108.6 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.832 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.8 p -72.54 -142.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.581 -1.645 . . . . 0.0 112.895 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.674 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 7.1 t70 86.61 -5.3 0.72 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.763 0.792 . . . . 0.0 109.311 -176.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.46 -73.03 0.66 Allowed 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.341 177.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.0 m-20 -32.94 -77.26 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.789 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.478 ' N ' ' HB2' ' B' ' 129' ' ' SER . 1.8 m 167.22 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.188 0.518 . . . . 0.0 111.106 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.913 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -84.6 -47.14 10.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 179.728 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.9 mt-30 -48.91 -38.94 24.23 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -174.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.68 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -52.07 -57.61 9.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.485 1.038 . . . . 0.0 111.574 179.17 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.003 ' CD1' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -55.4 -44.25 76.01 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.648 -177.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -76.28 -25.65 55.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.065 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -29.27 53.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.732 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.654 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.4 m-30 -87.71 -46.24 9.67 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 177.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 138.51 34.94 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.874 1.359 . . . . 0.0 111.223 177.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.56 ' HB ' HD13 ' A' ' 17' ' ' LEU . 16.4 t -116.01 76.59 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.014 0.435 . . . . 0.0 111.875 -178.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 16.2 p30 -67.84 44.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER 39.52 1.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 178.044 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' ASN . 6.9 p -38.57 -63.59 0.5 Allowed 'General case' 0 C--O 1.244 0.802 0 CA-C-N 119.048 0.84 . . . . 0.0 110.904 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.422 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -86.22 -21.37 52.36 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.613 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 1.003 HD12 ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -71.2 -62.54 1.36 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.896 0.348 . . . . 0.0 111.223 -179.376 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.028 HG21 HG22 ' B' ' 128' ' ' VAL . 2.1 t -51.05 -62.23 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.679 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 17.8 p -48.83 -31.12 6.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 122.651 0.38 . . . . 0.0 111.842 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -77.06 -57.92 3.57 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 m -52.96 -44.64 67.26 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.158 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.799 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 3.4 mmt -49.34 -43.55 43.86 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.411 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.569 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -63.61 -48.77 75.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.106 0.412 . . . . 0.0 110.44 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -60.82 -53.34 58.51 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.686 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -61.6 -41.8 97.95 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.269 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.783 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -58.46 -44.44 89.26 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.352 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.401 ' NH2' ' OE1' ' A' ' 33' ' ' GLN . 4.6 mtt-85 -69.5 -54.53 13.76 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 34' ' ' ASN . 3.8 mmp_? . . . . . 0 N--CA 1.445 -0.721 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.232 -178.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.647 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 15.4 mmtt . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.674 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 11.5 tp60 -125.97 124.64 41.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.083 0.468 . . . . 0.0 111.231 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.463 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.31 112.24 16.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.032 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.934 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -107.16 128.94 61.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.182 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.175 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.789 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.47 120.18 22.63 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.696 -179.804 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.67 HG23 HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -103.5 93.69 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 174.342 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.882 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.8 p -70.52 89.31 0.7 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.045 -1.034 . . . . 0.0 109.687 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 21.6 m -141.35 -0.98 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.781 ' CB ' ' HB3' ' A' ' 3' ' ' GLN . 0.0 OUTLIER 17.85 -74.65 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.645 1.111 . . . . 0.0 112.209 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.62 ' N ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -66.7 -20.16 65.91 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -179.143 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.696 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 1.2 t0 -78.72 62.8 3.33 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 120.017 1.28 . . . . 0.0 111.132 -178.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.569 ' HB3' ' CA ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER 58.91 -24.87 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 179.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.804 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.02 -56.52 3.29 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-O 121.708 0.766 . . . . 0.0 110.424 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.591 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 20.3 pt20 -49.54 -39.93 36.37 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.713 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.783 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -60.61 -43.84 97.0 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.664 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.799 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.45 -50.03 74.43 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.457 0.646 . . . . 0.0 111.439 -179.314 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.8 pttt -70.13 -25.88 63.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.581 178.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -60.38 -26.67 66.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.54 177.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.691 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.7 OUTLIER -88.41 -44.94 10.38 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.372 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.691 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 150.13 63.0 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 176.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.735 ' CG1' HD23 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -157.6 -42.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.985 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.2 OUTLIER 58.18 59.26 3.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.465 0.65 . . . . 0.0 110.014 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.999 ' HB ' HG23 ' B' ' 128' ' ' VAL . 0.5 OUTLIER 40.53 -11.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 118.478 2.77 . . . . 0.0 118.478 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.736 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.03 -56.43 1.15 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.112 -177.888 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.76 -24.63 52.66 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.533 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.87 ' HB3' HG22 ' B' ' 124' ' ' ILE . 1.0 OUTLIER -70.32 -61.48 1.76 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.971 0.509 . . . . 0.0 111.142 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.028 HG22 HG21 ' A' ' 28' ' ' VAL . 71.0 t -46.42 -54.4 2.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.787 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.05 -40.73 86.01 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 90.6 m -74.05 -49.84 22.36 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.606 HG22 ' O ' ' B' ' 128' ' ' VAL . 3.4 t -55.34 -30.86 61.08 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.674 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.844 ' HE1' HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.69 -57.61 11.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.779 179.023 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -46.03 85.07 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -64.54 -50.59 66.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.812 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.593 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -71.84 -25.04 61.81 Favored 'General case' 0 C--O 1.217 -0.642 0 C-N-CA 120.349 -0.54 . . . . 0.0 110.069 178.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.68 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.56 -46.33 59.72 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 177.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -60.17 -56.02 26.66 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.505 0.669 . . . . 0.0 110.126 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? . . . . . 0 N--CA 1.445 -0.679 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.866 -177.559 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 120.351 0.119 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.848 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -122.77 110.02 14.94 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.651 0.739 . . . . 0.0 111.528 -179.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.886 ' HG3' HG23 ' B' ' 108' ' ' THR . 3.2 ttm105 -83.64 113.96 21.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.246 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.035 HD11 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -104.51 130.6 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.811 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -126.79 126.01 42.68 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.806 -0.758 . . . . 0.0 112.735 -177.469 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 HG22 ' B' ' 105' ' ' ILE . 0.6 OUTLIER -100.51 109.09 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.627 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.448 HG22 ' NH1' ' B' ' 104' ' ' ARG . 15.2 p -70.67 68.31 0.39 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.683 0.754 . . . . 0.0 109.333 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.835 HG11 ' CB ' ' A' ' 14' ' ' TYR . 8.3 p -76.23 -143.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.253 -1.34 . . . . 0.0 111.795 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.72 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 7.2 t70 87.43 1.56 0.44 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-O 122.067 0.937 . . . . 0.0 109.86 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.5 m -129.24 -64.72 0.89 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.18 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.823 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 1.2 m-20 -42.37 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.998 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m 178.54 41.61 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.607 0.639 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.912 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.5 OUTLIER -82.83 -49.48 9.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -179.166 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 4.1 mm-40 -48.15 -36.55 13.69 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -173.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.99 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.8 -53.29 59.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.86 0.754 . . . . 0.0 112.183 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.894 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.97 -45.76 51.78 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.236 0.541 . . . . 0.0 111.553 -178.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -77.73 -25.73 49.48 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.852 178.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -62.04 -28.65 69.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.621 178.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.692 ' CZ ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.12 -41.93 12.7 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.587 178.386 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.669 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 154.23 14.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 176.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 70.3 t -152.66 92.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 121.794 -0.566 . . . . 0.0 112.086 -177.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.465 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 4.8 p30 -58.41 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.06 HD11 HD12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -146.29 -2.67 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 115.599 1.704 . . . . 0.0 115.599 178.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -39.29 -64.37 0.47 Allowed 'General case' 0 C--O 1.245 0.82 0 C-N-CA 119.922 -0.711 . . . . 0.0 109.346 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.62 -28.67 26.2 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.058 -0.591 . . . . 0.0 111.964 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.688 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.71 -61.12 2.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.597 0.359 . . . . 0.0 110.752 179.238 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.056 HG22 HG21 ' B' ' 124' ' ' ILE . 2.4 t -51.98 -63.72 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 5.4 p -49.15 -39.05 27.41 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.5 m -71.88 -58.42 3.48 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.2 m -53.92 -42.84 69.22 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.01 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.002 ' HE1' HG23 ' B' ' 124' ' ' ILE . 11.4 mmt -56.61 -57.3 12.98 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.855 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -38.84 65.34 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -53.5 24.97 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.349 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.794 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -67.84 -25.94 65.8 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.248 178.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.573 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.93 -43.7 64.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -50.62 72.83 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.939 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.449 -0.522 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.221 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt . . . . . 0 N--CA 1.467 0.409 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.72 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.2 tt0 -113.97 126.25 54.93 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.355 0.598 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.503 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.86 108.32 11.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.433 -178.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.06 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -101.59 109.22 25.32 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.962 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.192 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.732 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -116.91 114.97 24.6 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.468 -178.488 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 1.035 HG13 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.31 111.94 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.886 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -70.02 91.47 0.68 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -179.704 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.96 HG22 HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -96.28 -158.88 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 112.152 -178.228 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.848 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 13.3 t70 96.71 -5.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.23 -61.55 1.66 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 175.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -49.93 -90.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.692 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 33.3 t -179.68 40.25 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.168 0.895 . . . . 0.0 111.229 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.98 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 1.1 t80 -82.71 -50.13 9.04 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.3 OUTLIER -47.39 -38.41 13.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.581 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.573 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.05 -44.0 64.06 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.612 1.096 . . . . 0.0 112.349 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -68.07 -47.76 67.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.075 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.613 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 2.8 pttt -72.06 -29.88 64.58 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.552 0.692 . . . . 0.0 110.483 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.98 -28.75 67.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.463 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.555 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.4 OUTLIER -88.46 -42.58 12.04 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.591 -0.719 . . . . 0.0 110.476 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.6 28.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 177.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.533 ' O ' HD23 ' B' ' 117' ' ' LEU . 68.7 t -160.65 96.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 122.209 -0.307 . . . . 0.0 111.726 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.613 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 2.5 m-20 -60.03 -102.75 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 178.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.056 HG21 HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -145.12 6.83 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 179.037 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 124' ' ' ILE . 2.6 p -41.6 -64.25 0.6 Allowed 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.629 0.728 . . . . 0.0 109.687 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.91 -23.19 42.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.658 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.823 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.47 -57.27 11.83 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.719 0.259 . . . . 0.0 111.018 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.057 HG22 HG21 ' A' ' 24' ' ' ILE . 5.4 t -54.21 -62.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.823 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 14.8 p -50.42 -44.19 55.09 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 87.5 m -68.55 -57.34 5.92 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.465 HG22 ' O ' ' B' ' 128' ' ' VAL . 0.7 OUTLIER -54.0 -44.41 70.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.397 179.594 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.929 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.3 mtt -60.21 -58.02 10.31 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.438 178.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.433 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.0 OUTLIER -49.35 -44.56 44.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.4 -179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -64.1 -57.4 9.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.565 0.222 . . . . 0.0 110.778 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.445 ' HB2' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.4 -15.18 62.81 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.99 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.69 -29.1 20.13 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 123.234 0.613 . . . . 0.0 111.089 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.58 -48.68 10.7 Favored 'General case' 0 CA--C 1.504 -0.825 0 CA-C-O 121.909 0.861 . . . . 0.0 110.118 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 . . . . . 0 C--N 1.319 -0.724 0 CA-C-N 113.771 -1.559 . . . . 0.0 114.298 -176.983 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 121.065 0.46 . . . . 0.0 111.037 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.748 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -103.81 111.87 24.57 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.344 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.89 105.89 9.38 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.121 -178.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.669 HG12 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -103.94 120.98 54.91 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.993 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 175.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.738 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -124.76 124.15 41.52 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.894 -177.199 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.792 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.74 108.08 21.99 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 27.3 p -70.64 89.96 0.74 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.753 0.311 . . . . 0.0 110.997 -178.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.004 HG21 ' CB ' ' A' ' 14' ' ' TYR . 3.0 t -84.44 -133.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.928 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.551 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.7 t0 85.73 -9.93 0.75 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t -135.21 -54.19 0.8 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.388 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.755 ' HB2' HG13 ' A' ' 9' ' ' VAL . 1.4 m-20 -47.39 -103.28 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -178.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.61 35.32 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.767 0.794 . . . . 0.0 111.05 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.004 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.0 -38.68 22.3 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.595 1.158 . . . . 0.0 112.608 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.63 -43.99 36.88 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -176.259 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.79 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -54.35 -44.07 71.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.316 0.962 . . . . 0.0 112.26 -179.41 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.013 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.2 OUTLIER -59.15 -52.38 65.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.622 0.725 . . . . 0.0 111.239 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -74.01 -29.37 61.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.752 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.4 -27.93 69.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.267 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.807 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -88.41 -45.02 10.32 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 118.585 -0.722 . . . . 0.0 110.356 179.096 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.677 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 159.85 18.89 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.029 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.671 ' O ' HD12 ' A' ' 17' ' ' LEU . 65.3 t -157.87 98.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 CA-C-N 118.411 0.551 . . . . 0.0 112.017 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 31.1 m-80 -57.31 -96.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.032 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.71 5.87 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 178.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.426 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.2 t -39.34 -64.58 0.45 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.399 -177.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.86 -25.87 28.38 Favored Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.433 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.705 HD12 ' CD1' ' A' ' 17' ' ' LEU . 6.6 tt -58.61 -61.65 2.44 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.992 0.425 . . . . 0.0 109.885 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.032 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.3 t -49.96 -62.8 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.965 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.861 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.897 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 95.4 p -49.45 -43.42 44.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.05 -47.91 40.65 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.254 -0.646 . . . . 0.0 109.254 179.68 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.612 HG21 HG21 ' B' ' 131' ' ' THR . 23.3 m -61.47 -34.59 75.72 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.6 OUTLIER -63.97 -56.86 12.04 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.79 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.51 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -50.23 -34.13 21.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.69 0.281 . . . . 0.0 110.752 179.504 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.4 m-20 -75.36 -50.29 16.4 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.168 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.724 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 mm-40 -67.76 -23.47 65.23 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.06 178.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.669 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.0 -50.12 24.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -56.1 10.42 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.295 178.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.518 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.394 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.433 ' HD3' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.155 0.502 . . . . 0.0 110.911 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.551 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 27.2 tt0 -98.79 114.23 26.69 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.887 179.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.522 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.76 102.33 7.12 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.453 -178.164 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.742 HD11 HG11 ' B' ' 128' ' ' VAL . 1.1 pt -100.79 109.74 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.696 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.71 117.18 29.55 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -175.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.807 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -101.16 104.47 16.31 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 173.794 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.862 HG22 ' HG3' ' A' ' 4' ' ' ARG . 44.6 p -70.1 85.12 0.54 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.209 0.528 . . . . 0.0 110.774 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.6 t -82.3 -138.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.064 -178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 4.3 t70 86.03 -5.34 0.8 Allowed 'General case' 0 C--N 1.35 0.624 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.54 -63.13 1.1 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.508 -1.223 . . . . 0.0 107.919 177.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.897 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -47.25 -92.44 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -179.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 26.6 t -178.82 40.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 118.903 0.774 . . . . 0.0 111.435 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.872 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.9 -41.5 18.83 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.759 0.824 . . . . 0.0 112.529 179.709 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.647 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.75 -39.55 25.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -174.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.669 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.49 -50.72 72.83 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.413 1.006 . . . . 0.0 111.944 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.957 HD23 ' CE2' ' B' ' 120' ' ' TYR . 2.1 mt -53.8 -43.57 69.45 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.599 0.714 . . . . 0.0 111.767 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 7.8 pttt -79.19 -32.53 44.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.52 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.482 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -61.93 -26.5 68.22 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.573 -1.194 . . . . 0.0 110.166 178.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.957 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.09 -39.52 14.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.881 179.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.67 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 26.2 t0 138.14 49.95 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.729 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -159.96 -37.06 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.891 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' B' ' 122' ' ' VAL . 11.9 p30 55.61 -109.61 0.5 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.047 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -144.2 1.38 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.792 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 t -38.82 -64.28 0.45 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.871 -178.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -89.35 -26.88 24.4 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.769 177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.65 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -55.66 -61.84 2.09 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.227 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.047 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.7 t -54.37 -55.49 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.312 0.577 . . . . 0.0 110.044 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.709 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 29.1 t -47.14 -47.66 23.49 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.1 -47.07 12.04 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.657 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.612 HG21 HG21 ' A' ' 31' ' ' THR . 2.4 m -56.43 -48.27 77.33 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.695 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.867 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 5.5 mmt -51.62 -48.55 63.25 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.768 179.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -54.58 -36.38 64.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -48.31 46.06 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 1.013 ' HB3' HD21 ' A' ' 17' ' ' LEU . 5.4 tt0 -74.62 -21.7 59.32 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.943 0.402 . . . . 0.0 110.376 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -78.09 -32.98 50.91 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.282 0.633 . . . . 0.0 110.754 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.2 mtt85 -81.98 -51.97 7.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.592 0.71 . . . . 0.0 110.655 179.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -176.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.669 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' B' ' 108' ' ' THR . 59.9 tp60 -100.14 120.33 39.71 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.016 0.436 . . . . 0.0 110.869 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.0 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.3 ttm-85 -79.29 112.44 16.52 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -177.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.784 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -118.2 122.18 68.99 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 176.77 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.753 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -131.54 140.36 49.47 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 118.918 -1.113 . . . . 0.0 112.909 -178.168 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.75 HG23 ' HB ' ' A' ' 9' ' ' VAL . 2.0 m -100.83 107.99 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.459 HG23 ' HG3' ' B' ' 104' ' ' ARG . 0.7 OUTLIER -70.42 67.64 0.34 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.622 0.725 . . . . 0.0 109.596 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.75 ' HB ' HG23 ' A' ' 7' ' ' VAL . 7.9 p -95.88 -137.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.03 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER 166.15 -82.83 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -178.903 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.618 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -104.8 9.89 34.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.19 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.752 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -80.22 68.33 6.33 Favored 'General case' 0 C--N 1.359 0.98 0 CA-C-N 119.807 1.185 . . . . 0.0 108.706 179.416 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB3' ' N ' ' B' ' 133' ' ' GLN . 2.6 m 61.16 -28.59 0.05 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.682 -1.144 . . . . 0.0 113.736 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.724 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -45.91 -60.26 2.35 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.149 0.5 . . . . 0.0 111.115 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.3 pt20 -48.75 -38.26 21.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.938 -177.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.674 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.02 -46.56 87.88 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.771 HD21 ' CB ' ' B' ' 135' ' ' GLU . 0.5 OUTLIER -55.34 -49.69 71.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.474 0.654 . . . . 0.0 110.849 -179.724 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.678 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.3 pttt -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.538 179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.23 -29.39 67.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.337 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.693 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.3 -44.33 10.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.526 178.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.589 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 152.28 27.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.393 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.5 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 76.4 t -160.15 87.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.678 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -53.89 -87.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.576 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.007 HD13 HG23 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -155.22 -1.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 179.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.804 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.3 p -38.91 -64.51 0.44 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-N 118.941 0.791 . . . . 0.0 111.681 -176.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.58 -19.99 57.26 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.774 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.712 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -66.8 -61.66 1.84 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 122.766 0.426 . . . . 0.0 110.741 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.935 HG23 ' CG2' ' A' ' 24' ' ' ILE . 10.0 t -50.55 -60.4 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 C-N-CA 120.309 -0.556 . . . . 0.0 109.923 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.864 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 8.8 p -50.1 -41.78 48.98 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.8 m -67.1 -52.47 41.51 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.516 HG22 HD11 ' B' ' 127' ' ' LEU . 49.1 m -61.24 -34.6 75.4 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.836 178.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.931 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.88 -58.15 6.25 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.562 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.464 ' OE1' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.92 -33.99 19.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.718 0.294 . . . . 0.0 110.885 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.41 -50.73 12.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.831 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.78 ' CB ' HD21 ' B' ' 117' ' ' LEU . 1.4 mm-40 -70.83 -19.14 62.69 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.318 177.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.788 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.49 -49.11 8.93 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.664 0.786 . . . . 0.0 110.88 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.464 ' HD2' ' OE1' ' A' ' 33' ' ' GLN . 4.7 mtt85 -57.49 -53.7 55.18 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.389 0.614 . . . . 0.0 110.886 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? . . . . . 0 N--CA 1.448 -0.565 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.869 -178.772 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.473 0 CA-C-O 120.592 0.235 . . . . 0.0 111.052 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.546 ' HG2' HG22 ' B' ' 105' ' ' ILE . 3.3 tt0 -109.93 110.57 21.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.132 0.492 . . . . 0.0 112.129 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.464 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 7.8 ttm105 -78.69 102.38 8.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.777 HD11 HG11 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -99.09 116.09 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 178.891 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.753 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -115.74 124.5 50.96 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.599 -176.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 1.007 HG23 HD13 ' A' ' 24' ' ' ILE . 1.1 t -100.6 98.7 7.23 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 1.0 HG22 ' HG3' ' A' ' 4' ' ' ARG . 48.4 p -70.16 98.66 1.37 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.97 -0.456 . . . . 0.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.104 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.0 t -88.98 -129.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.449 ' N ' HG12 ' B' ' 109' ' ' VAL . 22.5 t70 85.47 -9.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 67.3 p -131.5 -61.33 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.824 178.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.881 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -39.27 -92.54 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 28.5 t 170.85 39.38 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.731 0.776 . . . . 0.0 110.149 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.104 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -84.23 -45.17 13.16 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.26 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.7 -34.92 12.87 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.305 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.788 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -60.71 -56.92 15.51 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.678 0.672 . . . . 0.0 111.549 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.931 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.9 mt -47.16 -48.85 23.36 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.069 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -77.04 -26.21 53.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.643 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.82 -30.4 71.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.699 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.59 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.16 -41.41 13.02 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.789 178.408 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.563 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 152.95 26.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.029 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.777 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.6 OUTLIER -135.29 80.1 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -179.001 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.03 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.69 53.74 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.652 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER 42.35 -9.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 118.701 2.852 . . . . 0.0 118.701 178.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.565 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.25 -63.15 0.51 Allowed 'General case' 0 C--O 1.244 0.773 0 CA-C-N 119.601 1.091 . . . . 0.0 110.946 -176.966 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.49 -26.78 34.72 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.693 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.59 ' CD1' ' CD1' ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.4 -61.51 2.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.628 0.371 . . . . 0.0 110.436 179.332 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.968 HG23 ' CG2' ' B' ' 124' ' ' ILE . 4.0 t -47.74 -64.31 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.752 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.05 -34.8 10.06 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 178.574 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 98.8 m -72.44 -52.8 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -42.55 99.14 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.424 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.728 ' HE2' ' CG2' ' A' ' 24' ' ' ILE . 6.7 mmt -52.31 -51.17 60.13 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.674 179.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.498 ' N ' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.92 -36.91 68.25 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.702 0.287 . . . . 0.0 111.079 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.4 -52.51 26.25 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.771 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.77 -19.21 62.73 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.61 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.45 -28.82 21.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 122.776 0.43 . . . . 0.0 111.243 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -54.07 6.39 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 121.652 0.739 . . . . 0.0 109.871 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? . . . . . 0 N--CA 1.441 -0.892 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.12 -178.419 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.93 0.395 . . . . 0.0 110.981 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 36.7 tp60 -109.66 117.51 34.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.232 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.932 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.5 ttm180 -78.51 106.12 10.25 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 121.67 0.748 . . . . 0.0 112.221 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.969 HD13 ' CD1' ' B' ' 114' ' ' TYR . 7.0 pt -110.41 128.1 66.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 177.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.731 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.03 131.6 42.62 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 118.461 -1.295 . . . . 0.0 113.822 -177.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.95 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.48 105.39 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.428 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 7.4 p -70.55 91.68 0.8 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.281 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.022 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -88.58 -147.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.805 -178.908 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.589 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 28.4 t70 120.49 -0.28 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.327 1.051 . . . . 0.0 108.511 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.9 p -158.03 -33.12 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.079 -0.964 . . . . 0.0 112.694 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.743 ' HB2' HG13 ' A' ' 9' ' ' VAL . 2.3 m-20 -75.05 19.9 0.14 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -176.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.579 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 32.5 m 81.38 8.23 1.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 175.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.022 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -63.25 -45.77 90.01 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.504 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 7.4 mt-30 -49.62 -41.24 41.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -176.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.606 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -59.53 -48.46 81.56 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.006 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.4 OUTLIER -50.34 -56.91 9.3 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.525 0.679 . . . . 0.0 111.498 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.636 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 pttt -70.4 -25.83 63.41 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.113 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -65.71 -27.03 68.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.325 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.621 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.11 -38.69 15.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 118.316 -0.85 . . . . 0.0 110.264 178.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.3 m-20 148.98 33.84 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.0 t -151.08 88.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 121.821 -0.55 . . . . 0.0 112.429 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.037 ' O ' HD12 ' A' ' 24' ' ' ILE . 63.4 m-80 -70.04 60.82 0.18 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.3 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.037 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 40.65 -11.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 118.539 2.792 . . . . 0.0 118.539 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -38.1 -62.05 0.6 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.773 1.17 . . . . 0.0 110.787 -177.619 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.02 -30.97 40.59 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.231 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.537 ' HB3' HG22 ' A' ' 24' ' ' ILE . 2.8 tp -60.27 -61.68 2.42 Favored 'General case' 0 C--N 1.338 0.074 0 O-C-N 122.916 -0.167 . . . . 0.0 111.001 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.084 HG22 ' CG2' ' B' ' 128' ' ' VAL . 37.2 t -45.66 -66.31 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.063 0.459 . . . . 0.0 110.986 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 15.3 p -49.39 -44.08 44.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.408 ' O ' ' HG2' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -72.72 -44.85 61.19 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.177 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 m -54.42 -38.16 65.93 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.559 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.825 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 5.5 mmt -56.34 -57.38 12.52 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.58 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 30' ' ' THR . 4.5 pt20 -50.44 -38.63 44.45 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.74 0.305 . . . . 0.0 111.317 -179.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -69.88 -51.67 31.23 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.431 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.689 ' HB3' HD21 ' B' ' 117' ' ' LEU . 4.5 tp10 -68.72 -23.11 64.32 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.273 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.782 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -79.31 -46.02 18.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.572 0.349 . . . . 0.0 110.689 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.27 -50.8 68.71 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.913 0.863 . . . . 0.0 109.971 178.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.973 0 CA-C-N 113.392 -1.731 . . . . 0.0 113.486 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 8' ' ' THR . 7.6 tt0 -100.34 113.28 25.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.591 178.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.445 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 4.5 ttm180 -78.38 101.11 7.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.218 0.532 . . . . 0.0 110.607 -179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.748 HG12 HG13 ' A' ' 7' ' ' VAL . 0.6 OUTLIER -99.36 118.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.41 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.731 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -123.22 123.21 40.26 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.152 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.78 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.45 103.33 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 175.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.932 HG22 ' HG3' ' A' ' 4' ' ' ARG . 64.9 p -70.06 67.9 0.3 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.652 0.739 . . . . 0.0 109.751 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.035 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.0 p -70.31 -130.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 114.13 -1.396 . . . . 0.0 111.831 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.736 ' H ' HG22 ' B' ' 109' ' ' VAL . 25.9 t70 84.89 -5.38 0.95 Allowed 'General case' 0 N--CA 1.485 1.292 0 CA-C-N 119.893 1.224 . . . . 0.0 109.603 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.29 -64.54 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.642 177.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.81 -84.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.265 -179.816 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.96 44.29 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.132 0.491 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.035 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.35 -44.83 14.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.566 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.6 mp0 -48.85 -38.95 23.85 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.782 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.17 -56.72 9.84 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.727 0.694 . . . . 0.0 111.761 179.516 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.772 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.9 OUTLIER -58.33 -48.51 80.31 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.034 -179.005 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -73.41 -26.33 60.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.287 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.91 -25.25 42.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.874 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.619 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.4 m-30 -87.97 -51.72 5.66 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.6 m-20 144.45 48.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 O-C-N 124.36 1.038 . . . . 0.0 112.096 177.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.772 ' CG1' HD12 ' B' ' 117' ' ' LEU . 5.3 p -150.69 85.76 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.017 ' O ' HD12 ' B' ' 124' ' ' ILE . 43.1 m-80 -68.3 59.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.734 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.017 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.8 OUTLIER 37.42 1.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 178.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.09 -62.35 0.57 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.584 1.083 . . . . 0.0 110.373 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -83.33 -31.87 26.87 Favored Glycine 0 C--O 1.223 -0.574 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.169 178.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.769 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.66 -62.02 2.02 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.795 0.438 . . . . 0.0 111.888 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.084 ' CG2' HG22 ' A' ' 28' ' ' VAL . 1.8 t -52.34 -64.7 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.145 0.497 . . . . 0.0 110.929 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.731 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 84.6 p -50.46 -41.63 53.21 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.816 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.425 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 7.6 m -65.7 -51.88 55.8 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.1 -38.52 62.65 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.879 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.889 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.2 mtt -58.11 -55.52 33.83 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.974 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.579 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -50.57 -39.98 51.04 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.21 0.459 . . . . 0.0 111.115 179.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -68.79 -52.54 29.19 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.663 0.268 . . . . 0.0 110.754 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 1.006 ' HB3' HD21 ' A' ' 17' ' ' LEU . 22.6 tp10 -68.76 -22.03 64.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.208 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.606 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -80.08 -46.77 15.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.424 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -53.31 59.09 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 121.581 0.705 . . . . 0.0 110.325 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.44 -0.933 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.166 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.5 mttp . . . . . 0 N--CA 1.467 0.405 0 CA-C-O 120.919 0.39 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.604 ' HG2' ' CE2' ' B' ' 114' ' ' TYR . 5.0 tp60 -69.58 115.15 8.49 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.138 0.494 . . . . 0.0 110.211 178.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -78.1 99.23 6.07 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.778 0.799 . . . . 0.0 109.072 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.818 HD11 HG11 ' A' ' 28' ' ' VAL . 1.9 pt -99.34 120.22 48.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 107.022 -1.474 . . . . 0.0 107.022 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.66 126.21 34.07 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 118.755 -1.178 . . . . 0.0 114.129 -176.661 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.486 ' O ' HG22 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -99.45 109.47 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 175.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.406 HG23 ' NH1' ' B' ' 104' ' ' ARG . 1.6 p -70.67 94.77 1.04 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.865 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -99.59 -120.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.368 -177.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 4.7 t70 97.32 11.85 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 CA-C-O 122.088 0.946 . . . . 0.0 109.144 -175.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -170.69 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.386 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.748 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 0.0 OUTLIER -68.74 49.97 0.07 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -176.491 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.677 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.6 OUTLIER 52.26 12.59 0.23 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.448 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.876 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -67.17 -57.4 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.535 0.683 . . . . 0.0 112.159 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.808 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 6.6 mt-30 -50.29 -28.71 8.27 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -62.76 -57.17 11.87 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.416 0.553 . . . . 0.0 111.655 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.977 HD23 ' CE2' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -47.26 -48.56 24.54 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.89 0.852 . . . . 0.0 111.9 -179.187 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.71 ' CB ' ' HA ' ' A' ' 23' ' ' ASN . 3.5 pttt -79.27 -26.41 42.36 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.682 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.7 -22.96 63.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.005 179.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.977 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.01 -41.24 13.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.871 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 167.12 -12.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 177.045 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.594 ' O ' ' N ' ' A' ' 24' ' ' ILE . 75.2 t -109.6 80.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-O 120.539 0.209 . . . . 0.0 111.206 -178.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.074 ' C ' HD12 ' A' ' 24' ' ' ILE . 61.6 m-80 -63.4 60.69 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.185 0.517 . . . . 0.0 111.036 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.074 HD12 ' C ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER 46.01 -21.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 178.597 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.765 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.28 -63.8 0.47 Allowed 'General case' 0 C--O 1.245 0.862 0 CA-C-N 118.534 0.606 . . . . 0.0 112.21 -173.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.04 -14.26 72.58 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.29 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.779 HD12 HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -65.97 -61.26 2.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 122.343 0.257 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.966 HG23 HG22 ' A' ' 24' ' ' ILE . 55.7 t -51.09 -59.21 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.693 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 25.7 p -49.35 -36.81 22.58 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.532 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -74.31 -56.08 5.29 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.491 HG23 HD21 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -56.05 -44.37 78.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.696 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.862 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.6 mmt -52.57 -46.12 66.75 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.707 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.455 ' N ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.831 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -60.49 -51.81 67.87 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.684 ' HG3' HD11 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -63.45 -34.08 76.97 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.503 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.678 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -67.17 -45.39 77.12 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.999 0.428 . . . . 0.0 109.906 177.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -53.56 56.68 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.61 0.719 . . . . 0.0 109.986 178.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.444 -0.769 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.123 -178.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.238 0 CA-C-O 120.736 0.303 . . . . 0.0 110.503 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.644 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 14.4 tt0 -125.93 120.16 29.67 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.554 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 7.6 ttm-85 -79.69 116.6 19.97 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.197 -178.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.901 HD13 HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -113.36 129.77 68.53 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 176.424 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.716 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -129.12 131.7 47.27 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.262 -0.975 . . . . 0.0 112.461 -178.395 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.765 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.96 91.14 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 23.8 p -69.13 67.54 0.17 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 122.258 1.027 . . . . 0.0 109.735 -178.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.73 HG12 HG12 ' B' ' 107' ' ' VAL . 15.0 p -99.72 -129.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 113.717 -1.583 . . . . 0.0 110.623 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.701 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER 161.52 -84.84 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.008 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.453 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 45.2 t -102.8 11.25 37.81 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.815 -0.612 . . . . 0.0 112.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 3.1 t0 -79.24 61.32 3.31 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-N 119.785 1.175 . . . . 0.0 108.105 179.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' ' 29' ' ' SER . 66.0 m 63.33 -22.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.995 -1.002 . . . . 0.0 113.146 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.797 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -47.02 -59.53 3.06 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-O 121.14 0.495 . . . . 0.0 110.852 179.399 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.649 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.8 pt20 -48.49 -38.86 21.23 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.927 -177.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.678 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -55.98 -41.38 74.71 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.343 0.52 . . . . 0.0 112.051 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.849 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -64.62 -45.97 84.62 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.006 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.797 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -74.55 -26.05 59.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 178.782 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -65.46 -34.27 77.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.531 178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.707 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.21 -26.87 22.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.661 179.134 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.586 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 31.1 t70 124.76 61.32 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 121' ' ' ASP . 24.2 t -156.0 -47.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.536 ' CG ' ' HB3' ' B' ' 118' ' ' LYS . 12.8 m-80 68.69 -112.55 0.11 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 -176.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.982 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -150.02 1.69 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 177.725 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.421 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.89 -63.44 0.59 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.798 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.37 -30.04 20.39 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.071 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.786 HD22 ' HG ' ' B' ' 117' ' ' LEU . 10.5 tp -56.51 -61.6 2.3 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.624 0.212 . . . . 0.0 110.441 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.982 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -48.76 -60.12 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.748 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 2.2 t -49.0 -46.56 44.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -51.51 39.39 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 23.5 m -59.6 -36.02 75.46 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.584 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.958 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 1.9 mmt -62.9 -57.9 9.23 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.219 -179.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 1.0 OUTLIER -54.49 -33.46 59.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.512 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.04 -52.35 11.28 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' A' ' 17' ' ' LEU . 78.7 mm-40 -71.25 -20.99 62.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.012 0.434 . . . . 0.0 110.363 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.05 -31.88 34.28 Favored 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 123.122 0.569 . . . . 0.0 110.84 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -80.28 -52.55 7.58 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.58 0.705 . . . . 0.0 110.68 179.535 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 . . . . . 0 N--CA 1.445 -0.705 0 CA-C-N 114.489 -1.232 . . . . 0.0 112.704 -177.616 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.563 ' HE3' ' HA ' ' B' ' 109' ' ' VAL . 1.7 mmmt . . . . . 0 CA--C 1.54 0.567 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.844 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 2.8 tp60 -135.79 138.6 42.77 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.186 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.953 ' HG3' HG22 ' B' ' 108' ' ' THR . 8.1 ttm-85 -81.6 98.07 8.17 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.648 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.686 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -97.65 109.62 23.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.753 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.4 OUTLIER -116.95 121.59 41.86 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.921 -177.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.883 HG23 HD13 ' B' ' 124' ' ' ILE . 0.8 OUTLIER -98.96 102.55 13.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 176.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 5.9 p -70.15 67.38 0.3 Allowed 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.941 HG13 ' H ' ' A' ' 10' ' ' ASP . 13.4 p -97.95 -101.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.941 ' H ' HG13 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 70.91 -61.68 0.47 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 104.195 -2.52 . . . . 0.0 104.195 -174.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.561 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -36.58 -70.22 0.1 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 112.83 -1.987 . . . . 0.0 108.804 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.79 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -63.62 -61.54 2.25 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 -175.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 171.7 37.31 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 120.186 1.357 . . . . 0.0 113.347 -179.328 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.925 ' CE1' HD13 ' B' ' 105' ' ' ILE . 1.2 t80 -81.32 -50.5 9.43 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.611 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.1 mm-40 -49.88 -30.12 9.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -176.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.705 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.8 mt -55.5 -59.06 5.36 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.074 0.397 . . . . 0.0 111.306 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.767 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -55.17 -51.26 67.09 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.538 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -72.25 -25.95 61.82 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.234 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -58.39 -28.87 65.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.433 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.598 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.4 m-30 -88.09 -42.2 12.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.598 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 149.21 1.82 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 O-C-N 124.294 0.997 . . . . 0.0 112.347 178.455 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.578 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 16.5 t -94.05 71.46 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 121.938 -0.476 . . . . 0.0 112.12 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.958 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -61.43 47.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.958 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 40.33 -4.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 178.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.526 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -40.86 -55.97 2.33 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 120.066 1.303 . . . . 0.0 110.973 -178.707 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -28.1 24.45 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.499 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -63.45 -64.33 0.93 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 117.325 0.562 . . . . 0.0 110.143 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.75 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.7 t -51.3 -61.22 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.695 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 9.3 p -48.68 -27.24 2.74 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.134 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.2 m -83.25 -53.28 5.88 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.524 HG21 HD21 ' B' ' 127' ' ' LEU . 10.2 m -55.33 -50.82 68.64 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.642 0.734 . . . . 0.0 109.201 178.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.963 ' HE1' HG23 ' B' ' 124' ' ' ILE . 5.3 mmt -48.89 -50.08 36.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.526 -1.216 . . . . 0.0 111.955 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.496 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.93 -47.26 85.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.499 0.19 . . . . 0.0 110.922 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 72.4 m-20 -58.16 -53.97 52.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.765 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' HD21 ' B' ' 117' ' ' LEU . 27.6 mm-40 -69.25 -30.92 69.15 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.399 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -68.34 -30.64 69.66 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.241 0.543 . . . . 0.0 109.668 177.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 3.0 mmt180 -82.4 -52.15 7.17 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.922 0.867 . . . . 0.0 110.104 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 113.593 -1.639 . . . . 0.0 114.007 -176.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.431 ' HE3' ' HB2' ' A' ' 11' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.49 0 CA-C-O 120.674 0.273 . . . . 0.0 110.74 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.73 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 9.8 tt0 -135.45 134.64 39.81 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.481 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 8.6 ttm105 -79.56 116.19 19.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.287 0.565 . . . . 0.0 110.033 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.925 HD13 ' CE1' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -115.4 116.37 52.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.405 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -121.05 127.16 51.44 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -175.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.742 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -103.73 95.64 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.953 HG22 ' HG3' ' A' ' 4' ' ' ARG . 52.8 p -70.9 91.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.938 -1.101 . . . . 0.0 109.93 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.833 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 4.4 m -132.4 -30.17 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -177.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.844 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 7.9 t70 42.38 -88.1 0.01 OUTLIER 'General case' 0 C--N 1.343 0.302 0 CA-C-O 122.451 1.12 . . . . 0.0 108.721 -177.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.577 ' N ' ' O ' ' B' ' 109' ' ' VAL . 2.0 m -60.81 -18.31 54.66 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 112.542 -2.117 . . . . 0.0 114.991 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.833 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -79.5 62.3 3.78 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 120.194 1.361 . . . . 0.0 110.374 -178.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 29' ' ' SER . 17.0 m 57.98 -19.73 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.686 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -47.08 -54.24 10.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.496 0.665 . . . . 0.0 110.663 179.301 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.7 pt20 -50.18 -43.85 52.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.717 -1.128 . . . . 0.0 112.614 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.684 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -56.56 -45.16 81.41 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 120.874 0.369 . . . . 0.0 111.864 -179.476 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.98 ' CD1' HD12 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -55.14 -47.62 74.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.774 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -79.25 -33.14 43.8 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.205 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.15 66.51 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.914 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.644 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.67 -43.33 11.4 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.447 178.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 151.55 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 177.026 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.658 HG12 HD13 ' B' ' 117' ' ' LEU . 88.6 t -162.07 88.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.774 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -61.93 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.02 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -151.12 -0.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 178.453 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 8.7 t -38.71 -62.39 0.62 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.69 0.281 . . . . 0.0 110.63 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.415 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.99 -28.62 30.77 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.98 HD12 ' CD1' ' B' ' 117' ' ' LEU . 1.2 tt -62.61 -61.91 2.1 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.845 0.322 . . . . 0.0 110.902 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.02 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.9 t -53.09 -61.35 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.822 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.79 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 16.1 p -49.56 -45.58 47.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.5 OUTLIER -83.57 -50.68 8.0 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.806 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.575 ' HB ' HD23 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -54.47 -34.52 61.71 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.767 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.6 mmt -66.55 -52.52 44.78 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.054 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -42.06 61.35 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 122.143 -0.348 . . . . 0.0 111.191 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.3 m-20 -64.38 -55.68 19.42 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.858 0.361 . . . . 0.0 110.173 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -23.06 65.65 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.693 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.705 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -72.07 -40.14 68.5 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -52.85 14.12 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.842 0.83 . . . . 0.0 109.521 177.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.445 -0.684 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.027 -177.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.43 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 4.2 mpp? . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.449 0.166 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.737 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 17.9 mmtm 71.82 140.73 0.05 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.834 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.504 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 56.0 tt0 -112.35 120.4 41.56 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.205 0.526 . . . . 0.0 111.858 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.017 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -77.9 109.1 11.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.999 0.904 . . . . 0.0 111.798 -179.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.823 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -110.65 117.16 54.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.379 178.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.876 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -133.1 134.37 44.17 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 118.262 -1.375 . . . . 0.0 114.48 -177.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.874 HG12 HD13 ' B' ' 124' ' ' ILE . 1.4 m -99.72 111.68 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.969 HG23 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -71.6 67.85 0.56 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.013 -0.43 . . . . 0.0 111.975 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.806 HG22 HG22 ' A' ' 7' ' ' VAL . 3.2 m -99.03 -120.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.721 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.687 ' HA ' ' HB3' ' B' ' 103' ' ' GLN . 6.1 t70 157.61 -85.09 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.721 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -102.04 12.36 36.97 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 119.237 -0.411 . . . . 0.0 112.094 178.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.537 ' C ' ' H ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -73.43 60.39 0.63 Allowed 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.355 0.98 . . . . 0.0 108.47 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.558 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 48.8 m 61.52 -23.54 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.737 ' CG ' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -48.5 -60.63 2.53 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 123.173 0.589 . . . . 0.0 111.07 179.722 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.721 ' HG2' ' HA ' ' A' ' 11' ' ' SER . 0.8 OUTLIER -48.95 -36.94 18.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.804 -176.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.57 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.34 -49.52 77.5 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.915 ' CD1' HD22 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -51.57 -56.33 14.11 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.417 0.627 . . . . 0.0 111.653 -179.341 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 4.7 pttt -70.43 -28.38 64.99 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.72 -26.0 68.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.677 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.985 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -87.76 -41.18 13.48 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.98 178.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.558 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 157.18 35.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 177.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.597 ' CG1' ' O ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -167.56 96.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 122.149 0.975 . . . . 0.0 113.527 -179.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.968 ' O ' HD12 ' A' ' 24' ' ' ILE . 34.1 m-80 -67.26 66.23 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.134 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.968 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER 36.34 -6.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -38.36 -61.74 0.66 Allowed 'General case' 0 C--O 1.244 0.799 0 CA-C-N 119.569 1.077 . . . . 0.0 111.559 -177.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.83 -33.27 34.2 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.294 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.948 HD23 ' CG2' ' A' ' 24' ' ' ILE . 22.4 tp -62.36 -61.97 2.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 117.367 0.584 . . . . 0.0 111.707 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.794 HG23 ' CG2' ' A' ' 24' ' ' ILE . 17.6 t -46.15 -68.54 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 O-C-N 123.381 0.425 . . . . 0.0 110.204 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.583 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 2.9 m -49.96 -37.01 30.2 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -64.13 -51.41 64.06 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.2 m -60.99 -39.85 91.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.057 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.847 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 6.0 mmt -58.41 -57.77 11.47 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.817 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.417 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -52.79 -35.4 56.69 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.998 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -70.65 -55.87 7.75 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.61 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.962 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -69.75 -17.53 63.44 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 177.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -75.83 -50.54 14.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.91 -56.49 10.03 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.12 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -62.72 -47.82 81.9 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.47 -179.016 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 37.44 37.95 0.12 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.04 179.565 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.537 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -177.98 109.99 0.06 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.506 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 79.59 96.19 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 175.52 4.55 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.927 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.22 118.45 22.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.093 0.473 . . . . 0.0 111.671 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -122.21 176.23 5.96 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.75 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.594 ' HD2' ' CD ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -165.2 135.2 3.66 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.978 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.543 HG13 ' O ' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -160.42 104.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -108.73 -67.05 1.0 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -133.14 138.0 46.47 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.599 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.597 ' C ' ' HG3' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -72.12 79.52 0.95 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.012 0.434 . . . . 0.0 110.842 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.597 ' HG3' ' C ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 41.06 -94.77 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.953 -179.166 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.12 22.28 59.42 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 tpp 72.25 -53.12 0.7 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 122.622 0.369 . . . . 0.0 111.844 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.8 m -78.02 142.54 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -131.12 -168.67 2.04 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.96 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.521 HG23 ' H ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -152.6 -61.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.63 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . . . 68.1 97.81 0.06 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.291 0.567 . . . . 0.0 111.362 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.502 ' NH1' HG21 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -103.43 -27.43 12.41 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.929 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -160.88 -170.73 2.82 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.324 0.583 . . . . 0.0 112.443 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.84 HD13 HG13 ' B' ' 146' ' ' VAL . 1.3 pp -96.69 149.64 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.217 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.433 ' HG2' ' HE3' ' A' ' 45' ' ' LYS . 2.1 tt0 -144.53 -56.51 0.35 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.736 ' HA ' ' HB3' ' B' ' 147' ' ' GLU . 2.0 mtt -149.67 153.39 36.92 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.554 0.216 . . . . 0.0 111.306 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.492 ' ND2' ' HG3' ' B' ' 147' ' ' GLU . 10.7 p30 -110.62 156.42 20.99 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.782 0.325 . . . . 0.0 110.96 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.416 ' O ' ' CB ' ' A' ' 64' ' ' SER . . . -136.36 -44.07 0.1 OUTLIER Glycine 0 C--N 1.337 0.589 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.975 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 63' ' ' GLY . 6.1 t 84.6 -166.45 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.563 0.345 . . . . 0.0 110.772 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 54.99 -102.33 0.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.595 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -158.02 64.47 0.46 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.369 0.604 . . . . 0.0 111.448 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.608 ' HB3' ' CZ ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -155.38 -61.59 0.11 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.231 -179.246 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 61.18 173.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.571 ' HA ' ' HG2' ' B' ' 138' ' ' ARG . 0.6 OUTLIER -132.53 87.2 2.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.021 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 56' ' ' ALA . 19.0 mtpt -96.31 167.4 11.21 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.994 0.425 . . . . 0.0 111.605 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 72' ' ' TRP . 8.7 p-10 -93.7 116.2 28.67 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.172 0.51 . . . . 0.0 111.569 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.449 ' HB3' ' O ' ' A' ' 71' ' ' ASP . 24.9 p-90 . . . . . 0 C--O 1.251 1.15 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.263 179.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 120.196 0.046 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp -76.44 157.46 32.21 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.101 0.251 . . . . 0.0 110.486 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.687 ' HB3' ' HA ' ' A' ' 10' ' ' ASP . 4.9 tt0 -113.59 116.51 29.62 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.278 0.561 . . . . 0.0 111.753 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.969 ' CZ ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -79.07 113.92 17.6 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.653 178.34 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.737 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -106.05 122.65 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.755 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.876 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -125.45 123.78 39.99 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.469 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.823 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.8 104.1 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 173.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 1.017 HG22 ' HG3' ' A' ' 4' ' ' ARG . 55.2 p -70.24 89.79 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.826 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.5 t -82.75 -131.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.0 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.737 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 22.3 t0 86.34 -3.39 0.73 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -175.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.5 m -137.04 -59.27 0.7 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.514 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.583 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -46.15 -91.6 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.5 OUTLIER 179.11 36.53 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.047 0 O-C-N 121.528 -0.733 . . . . 0.0 110.63 -178.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.936 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -82.24 -46.16 14.07 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -178.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.562 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.82 -34.73 12.97 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.772 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -59.85 -56.93 15.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.424 0.556 . . . . 0.0 112.288 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.962 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -53.46 -40.61 65.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 119.856 -0.737 . . . . 0.0 111.495 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.659 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -79.15 -26.89 42.72 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 0.0 110.196 178.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -62.03 -29.82 70.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.738 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.753 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -88.0 -44.07 11.27 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.548 -0.739 . . . . 0.0 109.708 178.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.705 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 t0 160.21 15.82 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 177.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.469 ' O ' HD23 ' B' ' 117' ' ' LEU . 60.9 t -154.28 93.35 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-N 118.848 0.749 . . . . 0.0 112.938 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.606 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.3 m120 -56.58 -97.64 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.73 -1.28 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.9 OUTLIER -39.27 -64.47 0.46 Allowed 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.202 -177.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.22 -26.63 35.99 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 121.1 -0.572 . . . . 0.0 112.449 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.728 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.79 -61.09 2.75 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.065 0.46 . . . . 0.0 110.641 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.19 HG13 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -49.03 -66.38 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.965 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.584 ' N ' HG12 ' B' ' 128' ' ' VAL . 94.9 p -49.27 -35.22 17.23 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 29.0 m -70.76 -53.72 14.43 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.447 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -62.55 -41.0 98.61 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.111 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.19 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -56.72 -51.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.325 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.558 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.81 -39.3 71.16 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 121.024 -0.271 . . . . 0.0 111.09 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -47.46 65.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.99 -27.82 68.42 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.025 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.597 ' O ' ' HB2' ' B' ' 139' ' ' LEU . . . -74.13 -52.33 12.88 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 122.919 0.487 . . . . 0.0 110.607 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.482 ' HA ' ' HD2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -54.16 -50.49 66.87 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.417 0.627 . . . . 0.0 110.724 178.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.594 ' CD ' ' HD2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -73.73 -32.97 64.12 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.964 -1.016 . . . . 0.0 112.561 -177.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.985 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -10.49 100.69 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -153.99 76.39 1.06 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.13 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -33.64 112.75 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.166 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -167.34 -173.53 2.29 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.224 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.443 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -160.55 175.25 12.92 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.952 179.301 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.405 ' O ' ' HE3' ' B' ' 145' ' ' LYS . 1.2 m-90 63.05 71.87 0.5 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.28 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.443 ' NZ ' ' O ' ' B' ' 143' ' ' ARG . 0.2 OUTLIER -150.62 138.05 19.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.84 HG13 HD13 ' A' ' 59' ' ' ILE . 3.2 p -106.49 173.39 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.849 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.736 ' HB3' ' HA ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -137.06 163.07 31.63 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.213 0.53 . . . . 0.0 112.222 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 179.36 53.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.987 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -157.95 157.87 33.9 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.83 0.348 . . . . 0.0 111.492 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -93.13 158.4 15.79 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.227 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -125.67 96.3 0.49 Allowed Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.327 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.561 ' O ' ' HB ' ' B' ' 153' ' ' VAL . 2.2 ttt -110.78 -141.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.071 0.148 . . . . 0.0 111.024 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' B' ' 152' ' ' MET . 50.7 t 80.96 143.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.06 0.544 . . . . 0.0 111.579 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.522 ' HB3' ' HB2' ' B' ' 172' ' ' TRP . 4.9 mp0 -132.68 164.52 26.55 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.425 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.468 HG22 ' O ' ' B' ' 155' ' ' VAL . 13.0 p 178.72 54.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.509 0.671 . . . . 0.0 111.803 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.423 ' HB2' ' HD1' ' B' ' 172' ' ' TRP . . . -73.87 159.03 33.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.965 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.89 143.67 26.39 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.174 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -106.39 110.27 22.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.848 0.356 . . . . 0.0 111.201 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.402 HG23 ' HG2' ' B' ' 160' ' ' GLU . 0.0 OUTLIER -174.49 -41.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.676 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.402 ' HG2' HG23 ' B' ' 159' ' ' ILE . 34.7 mm-40 -83.57 -77.94 0.24 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.377 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 4.4 ttm -178.64 -67.94 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.429 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 49.54 59.41 4.51 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.153 0.502 . . . . 0.0 111.986 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -84.2 61.86 4.66 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.034 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 25.2 p -98.55 84.42 3.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 120.93 0.395 . . . . 0.0 110.513 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.77 129.67 56.73 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.906 -179.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.56 ' HB1' ' HB3' ' B' ' 121' ' ' ASP . . . -162.35 -116.86 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.694 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -70.7 83.09 0.62 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.909 0.385 . . . . 0.0 111.504 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 37.7 46.44 0.72 Allowed 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.801 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -101.78 163.61 12.17 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.246 0.546 . . . . 0.0 112.024 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.81 165.76 22.64 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.665 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -60.53 166.88 2.89 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.003 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.522 ' HB2' ' HB3' ' B' ' 154' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.978 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.542 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.686 ' N3 ' H5'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.163 0 C3'-C2'-C1' 105.346 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.787 H2'' " O5'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 105.978 2.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.787 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 104.274 1.124 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.475 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.997 0 C1'-O4'-C4' 107.478 -1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.714 " H2'" ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C3'-C2'-C1' 105.199 1.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.853 ' H71' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.513 0 C4'-C3'-C2' 103.76 0.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.528 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C3'-C2'-C1' 105.892 2.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.518 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C3'-C2'-C1' 101.434 -0.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.482 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 104.311 1.151 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.494 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.978 0 C3'-C2'-C1' 105.125 1.732 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.494 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.708 0 N19-C1'-C2' 113.131 -0.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 C1'-O4'-C4' 110.478 0.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-C2' 107.074 0.886 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 O4'-C1'-C2' 107.224 1.022 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.641 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 102.046 -0.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.674 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.637 -0.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.674 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.864 0 C4'-C3'-C2' 104.537 1.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.527 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.92 0 C4'-C3'-C2' 104.813 1.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.713 ' H72' ' CG2' ' B' ' 106' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.837 0 C1'-O4'-C4' 106.839 -2.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.526 ' C8 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C3'-C2'-C1' 104.484 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.815 0 C4'-C3'-C2' 104.691 1.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.585 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-C2' 107.061 0.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.585 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.061 0 C1'-O4'-C4' 107.18 -1.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.433 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C4'-C3'-C2' 104.532 1.332 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.404 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.691 0 C4'-C3'-C2' 104.427 1.227 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 102.037 -0.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpp? . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.312 0.101 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.16 129.1 9.5 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.111 0.482 . . . . 0.0 111.71 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.615 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 34.4 tp60 -111.36 119.48 38.99 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.742 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.919 ' HG3' HG22 ' B' ' 108' ' ' THR . 9.0 ttp-105 -78.17 107.92 11.1 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.327 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.793 HD11 HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -109.33 116.47 52.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.128 178.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -121.51 124.03 43.43 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 119.8 -0.76 . . . . 0.0 112.921 -177.414 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.792 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.69 108.44 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 175.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.494 ' HB ' ' CG ' ' B' ' 102' ' ' LYS . 11.4 p -70.5 88.73 0.68 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.156 0.503 . . . . 0.0 110.54 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.148 HG21 ' CD1' ' A' ' 14' ' ' TYR . 15.8 m -81.9 -146.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.852 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.692 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 4.3 t70 87.82 -10.97 0.52 Allowed 'General case' 0 C--N 1.353 0.721 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -176.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.8 t -116.53 -69.84 0.83 Allowed 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.373 177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -51.68 -86.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -177.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.645 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 0.4 OUTLIER 178.77 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 120.416 1.462 . . . . 0.0 112.997 -178.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.148 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -82.96 -41.06 19.25 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.33 0.652 . . . . 0.0 112.615 179.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 1.5 mp0 -49.11 -42.91 40.74 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -175.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.717 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -55.26 -42.71 73.86 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.469 1.031 . . . . 0.0 112.445 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.949 HD12 ' HG2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -63.37 -55.12 27.08 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.108 -179.079 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -67.77 -26.0 65.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.495 0.664 . . . . 0.0 110.015 178.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -61.45 -31.77 71.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.594 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.902 ' CE2' HD21 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.5 -42.52 12.05 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 118.396 -0.811 . . . . 0.0 109.995 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 152.88 26.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.499 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.421 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.3 t -156.43 91.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 O-C-N 122.106 -0.371 . . . . 0.0 111.904 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -54.78 -92.01 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.952 HG21 HG22 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -153.84 1.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 115.874 1.805 . . . . 0.0 115.874 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.844 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.3 p -38.97 -63.72 0.51 Allowed 'General case' 0 C--O 1.246 0.915 0 C-N-CA 119.522 -0.871 . . . . 0.0 110.236 -177.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.86 -23.39 52.89 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.443 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.943 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -65.12 -60.88 2.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.825 0.313 . . . . 0.0 111.111 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.812 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.7 t -50.44 -65.28 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.401 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.651 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 12.9 p -48.62 -36.1 15.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.3 m -78.04 -52.28 9.02 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.667 HG23 HD21 ' B' ' 127' ' ' LEU . 0.7 OUTLIER -60.51 -41.15 93.75 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.605 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.795 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.2 mmt -54.87 -47.02 74.76 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.013 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.526 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 1.4 tt0 -60.46 -52.6 64.5 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.7 0.286 . . . . 0.0 110.805 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -48.1 76.41 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.014 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.586 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -69.8 -33.07 71.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.147 178.02 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.686 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -64.56 -45.71 85.89 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.513 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -62.26 -51.33 68.18 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.332 177.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' B' ' 170' ' ' LYS . 2.0 tpm_? -58.34 -43.96 88.5 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.429 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.4 OUTLIER -13.94 110.91 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.835 0.854 . . . . 0.0 112.503 179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -134.4 -85.3 0.42 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 40' ' ' ARG . . . 168.88 162.1 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.84 0.352 . . . . 0.0 111.553 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.59 93.27 0.9 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.094 0.473 . . . . 0.0 110.914 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' NE ' ' HA ' ' A' ' 43' ' ' ARG . 3.6 tpm_? -103.82 -12.86 16.66 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.883 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.2 t90 69.5 -59.05 0.5 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.453 ' O ' ' HB ' ' A' ' 46' ' ' VAL . 0.6 OUTLIER -140.59 149.77 42.77 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.345 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.453 ' HB ' ' O ' ' A' ' 45' ' ' LYS . 36.7 t 84.0 111.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.914 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -109.81 -162.63 0.81 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.613 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -166.07 138.86 4.05 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.793 0.33 . . . . 0.0 111.609 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.53 59.89 0.85 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.356 0.598 . . . . 0.0 110.828 179.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -106.88 58.71 0.63 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.658 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -174.16 -36.56 0.04 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 120.478 -0.867 . . . . 0.0 114.37 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.6 mmt 72.23 173.9 0.3 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 117.332 0.566 . . . . 0.0 111.229 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.417 HG23 ' CG ' ' A' ' 54' ' ' GLU . 7.3 m -120.39 -169.08 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HG2' ' CZ3' ' A' ' 72' ' ' TRP . 11.5 mt-10 72.59 141.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.282 0.563 . . . . 0.0 111.43 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 55' ' ' VAL . 11.4 p -134.96 31.04 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.021 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.56 61.81 0.24 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.247 0.546 . . . . 0.0 110.31 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' NH1' ' HA ' ' A' ' 55' ' ' VAL . 31.3 ptt-85 -164.22 44.17 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.246 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.78 -66.76 0.14 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.648 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -151.32 141.69 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 120.929 0.395 . . . . 0.0 111.371 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -75.78 167.42 21.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.331 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.99 127.01 30.1 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.232 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -84.9 -53.05 5.57 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.581 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.52 112.89 1.18 Allowed Glycine 0 C--N 1.336 0.582 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.124 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.9 t -137.99 153.21 49.44 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 111.709 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -85.72 -9.75 56.67 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.182 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -126.56 97.24 4.95 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.531 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.449 ' HB3' ' O ' ' A' ' 66' ' ' ALA . 45.2 t0 82.92 143.29 0.07 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.423 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -91.39 -67.45 0.85 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.981 179.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.19 -178.87 0.07 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.522 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.445 ' NZ ' HG11 ' A' ' 55' ' ' VAL . 0.0 OUTLIER 65.14 96.86 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.39 -179.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -58.37 -57.05 14.61 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.575 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.49 ' CB ' HG12 ' A' ' 55' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.735 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.433 ' O ' ' C ' ' B' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -27.37 119.57 0.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 O-C-N 123.567 0.542 . . . . 0.0 112.319 -178.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.505 ' HB3' HG23 ' A' ' 9' ' ' VAL . 24.9 tt0 -98.67 114.11 26.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.651 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.525 ' NE ' ' O4 ' ' D' ' 193' ' ' ' DT' . 14.7 ttm-85 -78.29 105.35 9.47 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.401 0.619 . . . . 0.0 112.233 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.792 HG12 HG13 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -106.63 126.4 62.47 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 176.293 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.694 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -124.44 127.81 48.07 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 119.94 -0.704 . . . . 0.0 112.154 -177.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.844 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.2 t -100.14 93.85 3.2 Favored 'Isoleucine or valine' 0 C--N 1.346 0.44 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.919 HG22 ' HG3' ' A' ' 4' ' ' ARG . 73.3 p -70.62 66.87 0.35 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.811 0.815 . . . . 0.0 109.434 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.754 HG12 HG12 ' B' ' 107' ' ' VAL . 7.5 p -90.55 -124.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 CA-C-N 113.905 -1.498 . . . . 0.0 108.816 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.646 ' H ' HG22 ' B' ' 109' ' ' VAL . 21.7 t70 158.41 -92.22 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.652 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 26.5 t -97.61 9.57 42.16 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.226 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.71 ' HB2' ' CG2' ' B' ' 109' ' ' VAL . 52.8 m-20 -80.37 68.91 6.7 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 117.794 -1.563 . . . . 0.0 108.242 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.758 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 61.97 -24.3 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.167 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.643 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -48.69 -62.36 1.55 Allowed 'General case' 0 C--N 1.348 0.506 0 CA-C-O 120.895 0.379 . . . . 0.0 111.313 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.652 ' HG2' ' HA ' ' B' ' 111' ' ' SER . 0.8 OUTLIER -49.85 -34.56 20.26 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.134 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.686 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -59.75 -56.1 26.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.832 HD21 HD13 ' B' ' 127' ' ' LEU . 0.1 OUTLIER -54.04 -44.46 71.05 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 120.412 -0.515 . . . . 0.0 112.226 -177.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.712 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER -70.57 -25.66 63.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 178.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.576 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -63.88 -28.02 69.56 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.02 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.804 ' CE2' ' HG ' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -88.35 -41.4 12.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.749 -1.119 . . . . 0.0 110.715 178.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.641 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.7 m-20 146.42 45.1 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.503 HG21 ' HB3' ' B' ' 166' ' ' ALA . 25.7 t -150.9 -43.85 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.712 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 5.2 m-80 73.06 -121.09 0.05 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.143 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -138.3 0.26 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 C-N-CA 119.515 -0.874 . . . . 0.0 113.308 177.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.438 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -39.65 -63.14 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.094 0.473 . . . . 0.0 109.784 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.636 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -88.21 -33.98 10.13 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.329 178.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.832 HD13 HD21 ' B' ' 117' ' ' LEU . 9.1 tp -54.65 -62.35 1.71 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 117.149 0.475 . . . . 0.0 111.168 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.143 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.9 t -52.07 -62.34 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.313 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 20.9 p -52.46 -44.31 65.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.636 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -73.22 -49.14 29.58 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' B' ' 135' ' ' GLU . 2.8 m -53.72 -52.25 60.69 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.963 ' SD ' HG13 ' B' ' 128' ' ' VAL . 8.9 mtt -55.37 -53.77 51.98 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -52.58 -42.59 64.65 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.443 179.519 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -65.64 -54.45 27.48 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.557 ' O ' ' HG ' ' B' ' 139' ' ' LEU . 6.7 mm-40 -60.65 -28.05 68.28 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.866 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.717 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -76.02 -50.91 13.51 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.602 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -49.16 62.51 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.964 0.888 . . . . 0.0 109.529 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' B' ' 140' ' ' ARG . 3.6 mmt180 -69.96 -16.78 63.25 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.579 -1.646 . . . . 0.0 113.412 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.902 HD21 ' CE2' ' A' ' 20' ' ' TYR . 47.3 mt -43.48 82.56 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER 171.83 105.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.71 179.732 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 68.66 0.26 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.024 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.73 -49.49 10.52 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.847 0.356 . . . . 0.0 110.262 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -136.52 -176.82 4.47 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.09 38.79 0.36 Allowed 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 120.687 0.28 . . . . 0.0 110.973 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 4.0 mtmp? 69.92 -174.72 0.19 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.666 0.386 . . . . 0.0 110.799 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 93.7 t -103.64 -71.8 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 52.83 -111.18 0.58 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.818 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 12.0 t30 66.63 121.11 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.944 0.402 . . . . 0.0 111.531 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.87 60.37 0.1 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.211 0.529 . . . . 0.0 110.898 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.06 -74.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.998 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 66.14 -60.65 0.15 Allowed Glycine 0 C--N 1.337 0.605 0 C-N-CA 121.42 -0.419 . . . . 0.0 113.619 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.821 ' O ' HG22 ' B' ' 153' ' ' VAL . 0.0 OUTLIER 65.09 75.17 0.37 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.667 0.387 . . . . 0.0 111.304 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.821 HG22 ' O ' ' B' ' 152' ' ' MET . 1.3 m 61.56 -164.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.782 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.638 ' N ' HG23 ' B' ' 153' ' ' VAL . 0.9 OUTLIER -87.43 154.07 20.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.578 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.793 HG22 ' CE2' ' B' ' 172' ' ' TRP . 3.7 m -141.45 27.01 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' B' ' 171' ' ' ASP . . . -87.16 137.48 32.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.834 0.35 . . . . 0.0 110.57 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . 0.455 ' HA ' ' HD3' ' B' ' 157' ' ' ARG . 0.0 OUTLIER -138.76 -165.51 1.84 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.732 0.301 . . . . 0.0 111.798 -179.105 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -62.61 67.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' B' ' 157' ' ' ARG . 9.2 mt -142.86 -54.79 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.611 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -112.26 -178.68 3.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.424 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.25 -80.22 0.58 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . 0.449 ' HB3' ' HA ' ' B' ' 171' ' ' ASP . 0.1 OUTLIER 67.9 35.95 3.63 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 179.869 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -155.75 177.9 32.61 Favored Glycine 0 C--N 1.336 0.582 0 CA-C-N 116.446 -0.343 . . . . 0.0 112.366 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.512 ' HB3' ' CD ' ' B' ' 168' ' ' GLU . 10.6 t -137.0 -155.35 0.61 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.247 0.523 . . . . 0.0 112.293 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.54 22.22 15.7 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -178.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.503 ' HB3' HG21 ' B' ' 122' ' ' VAL . . . -128.03 -98.65 0.37 Allowed 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.171 -0.33 . . . . 0.0 111.56 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -138.01 55.43 1.77 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.307 0.575 . . . . 0.0 111.128 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.571 ' HB2' ' HG3' ' A' ' 35' ' ' GLU . 1.1 pm0 -140.6 93.49 2.62 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.216 0.531 . . . . 0.0 110.85 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -138.47 125.67 21.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.465 ' CB ' ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -145.35 -46.86 0.22 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.487 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.563 ' HB3' ' HB3' ' B' ' 156' ' ' ALA . 0.6 OUTLIER 64.81 -83.58 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.193 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.793 ' CE2' HG22 ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.746 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.503 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C3'-C2'-C1' 101.848 -0.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.616 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 101.348 -0.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C3'-C2'-C1' 104.643 1.388 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.473 ' C2 ' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.986 0 C1'-O4'-C4' 107.07 -1.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.491 ' N2 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.806 0 C4'-C3'-C2' 104.734 1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.579 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.75 0 C4'-C3'-C2' 104.44 1.24 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.571 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C3'-C2'-C1' 104.916 1.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.725 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 N19-C1'-C2' 115.212 0.632 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.725 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.567 0 C3'-C2'-C1' 104.572 1.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.745 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.899 0 C3'-C2'-C1' 105.384 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.745 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 O4'-C1'-C2' 107.163 0.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.497 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 C1'-O4'-C4' 110.636 0.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.403 1.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.402 ' C7 ' ' H41' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 O4'-C1'-C2' 107.025 0.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.402 ' H41' ' C7 ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 107.004 0.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.533 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C4'-C3'-C2' 102.461 -0.739 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.533 ' C8 ' " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 C1'-O4'-C4' 110.434 0.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.524 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.404 -1.265 0 C1'-O4'-C4' 107.553 -1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.513 ' H72' ' CG2' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 C4'-C3'-C2' 104.221 1.021 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.504 ' C6 ' ' C2 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 C3'-C2'-C1' 105.356 1.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.525 ' O4 ' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C4'-C3'-C2' 104.53 1.33 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.548 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-C2' 106.984 0.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.548 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.018 0 C1'-O4'-C4' 106.965 -1.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.18 1.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.404 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 O4'-C1'-C2' 105.014 -0.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C4'-C3' 106.026 0.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 120.359 0.123 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -163.04 175.15 11.4 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.905 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.53 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.2 OUTLIER -123.93 102.12 7.61 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.405 0.622 . . . . 0.0 111.526 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.854 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 5.9 ttm105 -79.55 111.32 15.7 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.546 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.873 HG21 ' CD2' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -110.26 122.79 65.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.199 179.464 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.725 HG23 ' H73' ' C' ' 178' ' ' ' DT' . 0.5 OUTLIER -131.63 131.93 43.61 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.406 -0.918 . . . . 0.0 112.687 -177.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.993 HG22 HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.19 112.17 31.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.053 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.509 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 7.0 p -70.85 81.56 0.64 Allowed 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.923 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.101 HG21 ' CD2' ' A' ' 14' ' ' TYR . 7.0 m -77.39 -137.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.156 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.704 ' HB2' ' HB2' ' B' ' 103' ' ' GLN . 36.9 t70 84.88 -11.47 0.78 Allowed 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -122.13 -63.11 1.32 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.187 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.652 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 0.8 OUTLIER -48.16 -97.94 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.197 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.601 ' O ' ' HB2' ' B' ' 132' ' ' MET . 4.0 m -174.23 41.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.144 -0.972 . . . . 0.0 111.814 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.101 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -80.6 -41.59 23.7 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.0 -46.36 43.78 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -175.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -53.55 -44.82 69.55 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.574 0.625 . . . . 0.0 112.237 -179.351 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.085 HD23 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -63.5 -48.28 78.25 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.444 0.64 . . . . 0.0 111.626 -179.826 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.585 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -76.93 -29.97 55.9 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.145 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.44 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.06 -29.71 70.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.764 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.116 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.82 -43.71 11.03 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.61 179.012 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 155.51 37.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.863 ' HB ' HD22 ' A' ' 17' ' ' LEU . 47.6 t -150.82 86.55 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 121.115 -0.991 . . . . 0.0 113.062 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.976 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -76.59 54.38 0.95 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.164 0.506 . . . . 0.0 111.069 179.081 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.011 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.7 OUTLIER 39.55 -4.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 119.339 3.089 . . . . 0.0 119.339 178.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.65 ' HB2' ' P ' ' D' ' 190' ' ' ' DG' . 0.0 OUTLIER -38.69 -63.88 0.48 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 120.267 1.394 . . . . 0.0 110.578 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.511 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.35 -33.38 11.81 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.923 -0.655 . . . . 0.0 111.862 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.682 ' CD1' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -52.61 -61.64 2.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.919 0.39 . . . . 0.0 110.764 178.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.011 HG23 ' CG2' ' A' ' 24' ' ' ILE . 0.9 OUTLIER -53.18 -66.31 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.862 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.655 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 18.5 m -50.97 -41.74 59.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.46 -54.33 11.0 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.776 HG21 HG21 ' B' ' 131' ' ' THR . 17.1 m -54.12 -39.3 66.31 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.78 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.035 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.46 -51.31 58.13 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.178 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.549 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -48.6 -33.37 9.67 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.992 0.814 . . . . 0.0 110.16 179.69 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.3 -57.18 9.07 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.612 ' O ' ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.86 -10.34 59.51 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.603 178.537 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.929 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.49 -28.95 20.49 Favored 'General case' 0 N--CA 1.456 -0.134 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.11 -54.0 5.64 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.641 0.734 . . . . 0.0 109.708 179.066 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -33.01 50.22 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.188 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.041 HD23 ' CD2' ' B' ' 120' ' ' TYR . 1.3 mp 42.77 60.95 2.26 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.609 0.763 . . . . 0.0 112.547 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.668 ' NE ' ' HA ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -162.94 70.42 0.26 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.73 178.867 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.15 16.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.36 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 65.6 -67.12 0.14 Allowed 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.11 114.21 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.831 0.348 . . . . 0.0 111.392 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -101.61 133.02 46.95 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.928 0.394 . . . . 0.0 111.166 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -147.03 154.79 41.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.124 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.8 m -106.09 170.4 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.006 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.04 -67.9 0.72 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.793 0.33 . . . . 0.0 111.352 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -106.96 174.43 5.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.927 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -81.61 -79.81 0.16 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.444 ' HA ' ' O ' ' B' ' 144' ' ' TRP . 9.7 mp0 57.94 176.26 0.06 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.171 0.51 . . . . 0.0 112.137 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' A' ' 52' ' ' MET . . . 160.66 -99.98 0.18 Allowed Glycine 0 C--N 1.337 0.611 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.978 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.529 ' SD ' ' HG3' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 83.07 168.74 0.11 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.06 0.544 . . . . 0.0 111.865 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.487 HG12 ' H ' ' A' ' 54' ' ' GLU . 2.1 t -81.71 167.29 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.487 ' H ' HG12 ' A' ' 53' ' ' VAL . 11.4 mm-40 -64.0 -178.6 0.34 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.735 ' O ' HG13 ' A' ' 55' ' ' VAL . 0.8 OUTLIER -169.78 41.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 179.402 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -49.49 -53.33 23.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.23 -66.79 0.28 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.476 0.31 . . . . 0.0 111.724 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.0 t80 178.41 -71.34 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.559 0.218 . . . . 0.0 111.396 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.4 mt -147.48 125.98 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.741 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -129.87 -73.18 0.56 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.094 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 16.9 mtt -136.65 146.03 45.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -71.96 138.93 48.39 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 111.207 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 145.96 84.05 0.06 OUTLIER Glycine 0 C--N 1.334 0.467 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.591 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 86.2 p -79.75 85.92 5.39 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 111.784 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -95.79 -46.7 6.47 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.01 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.27 23.81 11.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.232 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 62.88 178.83 0.14 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.663 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -156.45 121.57 4.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.422 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -104.51 -98.74 0.32 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptt 179.25 133.84 0.09 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.484 0.183 . . . . 0.0 111.158 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.78 120.83 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.241 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.62 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 47.7 p-90 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.317 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.412 ' O ' ' NZ ' ' B' ' 102' ' ' LYS . 11.0 mmm . . . . . 0 N--CA 1.496 1.841 0 CA-C-O 120.989 0.423 . . . . 0.0 111.673 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.509 ' HD3' ' O ' ' A' ' 8' ' ' THR . 4.3 mmtm -149.22 125.85 11.04 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.744 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -94.87 113.58 25.33 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.0 0.428 . . . . 0.0 112.012 -179.473 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.61 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.46 97.81 7.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.942 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.768 HD13 ' CD1' ' A' ' 14' ' ' TYR . 8.9 pt -100.04 113.77 36.51 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.958 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.698 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -117.98 119.32 34.43 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.571 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.19 102.78 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 174.082 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.854 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 14.3 p -67.97 89.8 0.3 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.909 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.97 HG21 ' CB ' ' B' ' 114' ' ' TYR . 5.8 t -80.97 -126.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.455 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.66 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 81.65 -10.65 1.14 Allowed 'General case' 0 C--N 1.351 0.648 0 CA-C-N 118.86 0.755 . . . . 0.0 109.188 -176.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.3 m -128.25 -61.88 1.07 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.001 177.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.655 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.18 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -178.374 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.446 ' HB3' ' O ' ' A' ' 29' ' ' SER . 9.6 t -179.57 41.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.185 0.902 . . . . 0.0 111.428 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.97 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.68 -50.22 8.39 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.748 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.523 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.61 -41.35 41.97 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.787 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.929 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -51.33 -56.43 13.11 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.539 0.609 . . . . 0.0 110.981 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.684 HD13 ' CE2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER -45.9 -52.68 11.08 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.809 0.814 . . . . 0.0 111.56 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 15.3 pttt -79.43 -30.3 42.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.768 -1.105 . . . . 0.0 111.877 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -66.52 -22.11 66.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.471 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.041 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.13 -41.99 12.65 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.167 178.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.656 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.1 t70 170.81 25.43 0.0 OUTLIER 'General case' 0 C--N 1.359 0.999 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.58 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.4 OUTLIER -170.29 107.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.064 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.86 ' O ' HD12 ' B' ' 124' ' ' ILE . 71.6 m-80 -66.8 50.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.732 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.035 HG21 ' CE ' ' A' ' 32' ' ' MET . 1.9 pp 34.89 2.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 119.409 3.115 . . . . 0.0 119.409 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.44 -62.04 0.63 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.294 0.497 . . . . 0.0 110.689 -178.209 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -77.62 -24.7 64.51 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.645 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.653 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.8 tm? -67.67 -57.11 6.96 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.999 0.4 . . . . 0.0 110.774 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.977 HG23 ' HB ' ' B' ' 124' ' ' ILE . 88.3 t -50.19 -73.17 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.895 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.795 ' HA ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.43 -33.89 15.2 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 19.8 m -68.81 -47.36 66.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.776 HG21 HG21 ' A' ' 31' ' ' THR . 89.5 m -59.06 -39.61 82.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.516 177.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.028 ' HA ' HD12 ' A' ' 17' ' ' LEU . 14.7 mmm -57.54 -57.38 12.93 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.473 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -59.34 -38.11 79.54 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.074 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -68.15 -46.74 69.96 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.879 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -71.2 -28.82 64.5 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.601 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.823 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -78.96 -25.67 43.51 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.304 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.41 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 6.4 mtt-85 -82.54 -53.45 5.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.812 0.815 . . . . 0.0 110.487 178.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -17.49 62.37 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.054 -1.43 . . . . 0.0 114.164 -177.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.116 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -33.0 -46.02 0.14 Allowed 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.544 ' H ' HD12 ' B' ' 139' ' ' LEU . 0.3 OUTLIER -178.24 146.8 0.4 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.341 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 66.86 171.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -161.79 112.56 1.65 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.792 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.529 ' HG3' ' SD ' ' A' ' 52' ' ' MET . 0.0 OUTLIER -151.8 179.81 8.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.724 -0.216 . . . . 0.0 111.377 -179.476 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.444 ' O ' ' HA ' ' A' ' 50' ' ' GLU . 1.0 OUTLIER 80.76 50.66 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.769 0.428 . . . . 0.0 112.02 179.656 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.43 ' HE3' ' O ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -56.5 -46.54 80.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.832 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.4 p -87.92 124.74 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-O 120.888 0.375 . . . . 0.0 111.524 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.83 169.96 13.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.07 177.15 8.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 66.01 81.84 0.2 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.782 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.89 164.15 39.27 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.122 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 126.25 -64.58 0.57 Allowed Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.206 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.8 79.6 2.73 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.032 0.444 . . . . 0.0 111.45 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.9 m -113.73 142.92 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.996 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.59 ' O ' HG23 ' B' ' 155' ' ' VAL . 0.0 OUTLIER -137.42 -176.88 4.55 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.842 179.51 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.733 ' HA ' ' HB2' ' B' ' 172' ' ' TRP . 24.9 t -159.53 101.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 121.504 0.668 . . . . 0.0 111.104 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.405 ' H ' ' HD1' ' B' ' 172' ' ' TRP . . . -163.43 127.55 2.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.982 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.87 76.06 1.63 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.134 0.493 . . . . 0.0 111.614 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.8 t80 68.56 -60.37 0.43 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.479 HG23 ' H ' ' B' ' 160' ' ' GLU . 4.9 tp -138.46 -56.24 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.479 ' H ' HG23 ' B' ' 159' ' ' ILE . 0.0 OUTLIER -166.25 172.13 11.47 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.756 0.312 . . . . 0.0 111.224 -179.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 54.2 mtm -100.57 155.1 18.05 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -88.5 -44.49 10.66 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.365 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' B' ' 164' ' ' SER . . . 143.28 156.14 6.68 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 120.714 -0.755 . . . . 0.0 113.097 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.425 ' HB3' ' O ' ' B' ' 163' ' ' GLY . 22.0 t 76.77 141.81 0.07 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.797 0.439 . . . . 0.0 111.665 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' B' ' 168' ' ' GLU . 0.1 OUTLIER -166.54 117.12 0.95 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.36 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.6 ' HB3' ' CB ' ' B' ' 121' ' ' ASP . . . -95.99 -39.29 9.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.206 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.449 ' HB2' ' CE1' ' B' ' 120' ' ' TYR . 2.5 t0 -144.22 60.18 1.35 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.383 0.611 . . . . 0.0 111.447 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.637 ' HB3' ' CE1' ' B' ' 165' ' ' PHE . 5.8 tt0 -175.98 174.02 2.17 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.387 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -161.72 -73.36 0.06 Allowed 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.422 ' NZ ' ' O ' ' B' ' 155' ' ' VAL . 0.4 OUTLIER -139.79 141.45 36.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.871 0.367 . . . . 0.0 111.362 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.44 ' CA ' HG13 ' B' ' 155' ' ' VAL . 0.2 OUTLIER -157.95 168.58 26.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.984 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.733 ' HB2' ' HA ' ' B' ' 155' ' ' VAL . 2.0 t90 . . . . . 0 C--O 1.252 1.228 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.72 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 101.966 -0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.663 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 100.996 -1.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.663 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 O4'-C1'-C2' 107.284 1.076 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.459 ' H71' ' HG3' ' B' ' 102' ' ' LYS . . . . . . . . 0 O4'--C1' 1.407 -0.997 0 C1'-O4'-C4' 106.96 -1.957 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.639 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.772 0 C4'-C3'-C2' 104.8 1.6 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.725 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.411 -0.723 0 C4'-C3'-C2' 104.687 1.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.629 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C1'-C2' 107.084 0.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.629 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.715 0 C4'-C3'-C2' 104.305 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 107.017 0.833 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.625 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.9 0 C1'-O4'-C4' 107.405 -1.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.625 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 O4'-C1'-C2' 106.868 0.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.464 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 N19-C1'-C2' 115.141 0.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.048 0.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C4'-C3' 104.74 -0.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C4'-C3'-C2' 102.601 -0.599 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.415 " O5'" ' HD3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 O4'-C1'-C2' 107.263 1.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.559 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.868 0 C4'-C3'-C2' 104.639 1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.65 ' P ' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.036 0 C3'-C2'-C1' 104.837 1.526 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.592 ' H72' ' CG2' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 105.398 1.927 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.542 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.737 0 C4'-C3'-C2' 105.001 1.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.548 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.754 0 C3'-C2'-C1' 105.363 1.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.548 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.542 0 C3'-C2'-C1' 104.779 1.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.491 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 C3'-C2'-C1' 105.185 1.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 O4'-C1'-C2' 106.859 0.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.491 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 N19-C1'-C2' 115.616 0.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.467 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C1'-O4'-C4' 110.339 0.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 110.911 -0.033 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.0 ptpt -37.28 128.29 1.0 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.858 0.361 . . . . 0.0 111.617 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.622 ' O ' ' HA ' ' B' ' 108' ' ' THR . 34.5 tp60 -95.9 118.51 32.67 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.211 0.529 . . . . 0.0 110.997 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.969 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.84 105.82 9.28 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.698 0.761 . . . . 0.0 111.584 -178.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.72 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -108.99 111.51 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 177.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.66 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -116.49 128.38 55.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.517 -177.424 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.94 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -98.87 101.51 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 176.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.436 ' CG2' ' NH1' ' B' ' 104' ' ' ARG . 2.3 p -69.72 67.81 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.8 0.81 . . . . 0.0 109.272 -178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.982 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.4 p -79.9 -135.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.384 -178.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.785 ' H ' HG22 ' A' ' 9' ' ' VAL . 5.8 t70 91.2 -0.33 0.17 Allowed 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 119.591 1.087 . . . . 0.0 109.165 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.5 -55.98 0.69 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.673 177.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 0.6 OUTLIER -45.0 -87.18 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 123.526 0.516 . . . . 0.0 111.579 -179.487 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.561 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 0.3 OUTLIER 176.59 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 119.176 0.898 . . . . 0.0 111.771 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.39 -43.15 16.21 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -179.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.8 mp0 -49.83 -39.99 40.68 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -176.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.816 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -57.28 -56.6 19.75 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.829 HD13 HD11 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -54.15 -47.35 72.05 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 120.021 -0.672 . . . . 0.0 112.268 -177.36 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.719 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 pttt -73.24 -25.76 60.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.301 0.572 . . . . 0.0 110.01 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.1 -28.61 69.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.052 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.802 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.32 -43.12 11.77 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.305 178.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.6 t70 163.84 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.725 ' HB ' HD23 ' A' ' 17' ' ' LEU . 47.6 t -137.89 89.06 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 119.624 1.102 . . . . 0.0 113.588 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.6 m-80 -68.93 61.36 0.1 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.946 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 45.41 -16.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 117.871 2.545 . . . . 0.0 117.871 -179.362 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.573 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 7.8 t -37.61 -64.49 0.38 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.758 1.163 . . . . 0.0 112.013 -176.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.91 -22.45 57.72 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 178.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.829 HD11 HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.81 -62.05 1.72 Allowed 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 122.728 0.411 . . . . 0.0 110.767 179.644 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.97 HG23 ' CG2' ' A' ' 24' ' ' ILE . 5.2 t -48.79 -63.01 0.4 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.98 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.684 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.825 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -48.44 -36.45 14.94 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.595 HG23 ' CE ' ' A' ' 61' ' ' MET . 25.4 m -69.91 -52.66 22.76 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.615 HG21 ' HB ' ' B' ' 131' ' ' THR . 20.6 m -61.23 -39.24 89.55 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.86 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.885 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.7 mmt -60.06 -57.88 10.94 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.893 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.448 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 3.0 tt0 -57.16 -35.22 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -50.41 33.13 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.848 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.5 tp10 -72.96 -16.34 61.53 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.685 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -86.01 -47.95 9.12 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.815 0.446 . . . . 0.0 110.117 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 1.2 mmt180 -55.58 -52.03 65.12 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.57 0.7 . . . . 0.0 110.77 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -72.85 -50.46 23.82 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.957 -178.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.658 HD11 ' CD2' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 26.21 55.25 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.4 80.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 128.34 0.24 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.954 0.407 . . . . 0.0 112.084 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.53 157.47 18.07 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.112 0.482 . . . . 0.0 111.293 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -150.16 -61.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.261 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER 67.12 -59.6 0.38 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.337 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -104.09 115.2 29.99 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.189 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' A' ' 48' ' ' ASN . 2.7 t -114.93 32.54 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.619 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 53.31 -74.99 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' A' ' 46' ' ' VAL . 63.9 t30 60.37 29.17 18.79 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.627 0.251 . . . . 0.0 111.327 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -149.87 164.13 36.19 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.773 0.32 . . . . 0.0 111.403 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 56.0 -114.98 0.88 Allowed 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.333 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.8 164.87 11.31 Favored Glycine 0 C--N 1.339 0.713 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.351 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.627 ' HB2' ' HB3' ' B' ' 144' ' ' TRP . 0.3 OUTLIER -130.49 157.29 43.07 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.872 0.367 . . . . 0.0 111.559 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.477 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 91.3 t -80.51 -59.19 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.231 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.543 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.5 pm0 -72.31 148.64 45.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.683 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.695 ' CB ' ' HB2' ' B' ' 143' ' ' ARG . 15.9 m -130.05 21.74 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.49 ' HB2' ' CD1' ' A' ' 72' ' ' TRP . . . -74.38 64.02 1.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.06 0.457 . . . . 0.0 111.713 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -125.7 22.34 7.55 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.28 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.605 ' HB3' ' NH2' ' B' ' 143' ' ' ARG . 14.7 p90 -162.62 147.46 12.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.556 0.217 . . . . 0.0 111.447 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 pt -154.61 47.46 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.762 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -153.12 63.03 0.77 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.595 ' CE ' HG23 ' A' ' 30' ' ' THR . 0.1 OUTLIER -179.52 140.93 0.15 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.598 179.099 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -141.27 59.54 1.51 Allowed 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.823 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -157.17 -123.94 0.78 Allowed Glycine 0 C--N 1.334 0.421 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.436 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 65.92 -62.6 0.24 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.83 0.452 . . . . 0.0 111.19 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 44.19 75.84 0.09 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.27 -62.21 1.6 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.129 0.49 . . . . 0.0 111.661 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -171.3 -71.15 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.095 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -89.52 120.23 30.65 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.766 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.91 111.75 5.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.527 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -152.95 110.02 3.49 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.592 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.401 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.6 OUTLIER -118.69 -174.15 2.63 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.924 179.657 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.543 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 6.2 t-105 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.623 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 1.8 ttp . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.4 102.9 8.77 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 36.4 tt0 -101.97 114.6 28.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.243 0.544 . . . . 0.0 109.975 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.51 ' HD2' ' N7 ' ' D' ' 192' ' ' ' DA' . 11.9 ttm-85 -79.32 99.93 7.34 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.282 -177.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.65 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -108.1 110.31 31.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.72 ' O ' " H2'" ' D' ' 190' ' ' ' DG' . 0.3 OUTLIER -107.15 122.19 46.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.863 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.72 HG13 HG12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.08 95.11 3.76 Favored 'Isoleucine or valine' 0 C--N 1.343 0.285 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.969 HG22 ' HG3' ' A' ' 4' ' ' ARG . 74.3 p -68.16 94.03 0.48 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.248 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.088 HG21 ' HB3' ' B' ' 114' ' ' TYR . 3.0 t -80.9 -132.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.925 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.497 ' H ' HG12 ' B' ' 109' ' ' VAL . 19.9 t70 91.23 -12.53 0.24 Allowed 'General case' 0 C--N 1.351 0.637 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -129.66 -54.27 1.15 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.445 178.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.825 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.7 OUTLIER -48.72 -99.63 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -179.2 37.43 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.229 -0.92 . . . . 0.0 110.828 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.088 ' HB3' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.27 -39.14 21.23 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.944 1.091 . . . . 0.0 113.944 -179.062 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.3 -39.63 22.43 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -175.183 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.685 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -60.89 -56.68 18.27 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 1.105 HD22 HG11 ' B' ' 122' ' ' VAL . 1.5 mt -57.46 -38.19 74.09 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.318 -177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.63 ' HD3' ' OH ' ' B' ' 114' ' ' TYR . 0.8 OUTLIER -79.35 -31.23 42.96 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.155 0.503 . . . . 0.0 111.132 178.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.585 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.67 -28.92 67.69 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.364 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.072 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.28 -42.62 12.13 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 117.469 -1.253 . . . . 0.0 110.977 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.708 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 2.7 p30 151.35 12.03 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 1.105 HG11 HD22 ' B' ' 117' ' ' LEU . 1.4 p -89.83 -31.17 5.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 118.882 0.764 . . . . 0.0 112.886 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.008 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m-80 36.04 41.12 0.12 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.028 0.531 . . . . 0.0 111.621 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.008 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.5 OUTLIER 43.74 -8.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 N-CA-C 118.494 2.775 . . . . 0.0 118.494 179.438 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.94 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.87 -63.29 0.54 Allowed 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.114 1.324 . . . . 0.0 110.026 -177.842 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.43 -23.19 54.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.024 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.686 ' CD1' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.72 -61.05 2.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.521 0.328 . . . . 0.0 111.209 179.892 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.844 HG23 ' CG2' ' B' ' 124' ' ' ILE . 17.2 t -50.13 -63.69 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.459 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 13.5 p -49.9 -43.83 49.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 23.5 m -68.87 -53.68 19.88 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.633 HG22 ' O ' ' B' ' 128' ' ' VAL . 2.1 t -56.14 -40.23 73.47 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.688 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.814 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -62.09 -57.75 10.4 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.282 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.561 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 1.3 tp60 -49.65 -40.9 41.22 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.05 -0.26 . . . . 0.0 111.038 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.603 ' HB3' ' HG2' ' B' ' 142' ' ' GLU . 81.4 m-20 -69.56 -57.12 5.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.072 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.719 ' HB3' HD11 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -66.81 -14.73 62.99 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.333 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.14 -52.79 5.05 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.198 0.599 . . . . 0.0 111.689 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -54.96 -56.32 20.93 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.379 0.609 . . . . 0.0 111.825 -178.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.57 ' HB2' ' HB2' ' B' ' 142' ' ' GLU . 0.1 OUTLIER -83.15 -24.78 32.38 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.095 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.802 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 40.44 47.22 2.21 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-O 121.506 0.67 . . . . 0.0 111.116 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -168.14 -58.73 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.044 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.48 -44.39 0.22 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.603 ' HG2' ' HB3' ' B' ' 134' ' ' ASN . 3.8 tp10 54.12 82.36 0.09 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.695 ' HB2' ' CB ' ' A' ' 55' ' ' VAL . 23.8 mmt180 -149.59 122.93 9.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.785 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.627 ' HB3' ' HB2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -129.11 -162.21 1.18 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.712 0.291 . . . . 0.0 110.997 -179.181 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.503 ' O ' HG23 ' B' ' 146' ' ' VAL . 1.2 ttpt -67.71 -45.25 75.64 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER 52.4 66.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 121.344 0.592 . . . . 0.0 110.931 -179.508 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -87.9 171.33 10.43 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.44 116.07 25.3 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.534 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.64 155.12 4.74 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.136 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -135.63 157.68 46.28 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.124 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -104.99 -177.2 24.53 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.856 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.3 tpp -139.73 51.42 1.73 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.86 0.362 . . . . 0.0 111.509 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.8 p -179.14 123.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.4 ' O ' HG13 ' B' ' 155' ' ' VAL . 1.1 pm0 -115.05 148.08 39.34 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 111.845 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.4 HG13 ' O ' ' B' ' 154' ' ' GLU . 1.5 m -155.69 61.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.697 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -106.13 -43.67 4.77 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -152.44 173.35 15.22 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.495 0.188 . . . . 0.0 111.379 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -54.37 -39.63 67.35 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.781 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.7 mp -105.64 115.47 47.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-O 120.888 0.375 . . . . 0.0 110.873 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -66.67 156.63 34.71 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.398 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 4.3 ttt 68.65 88.21 0.11 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.643 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -54.99 -34.77 63.69 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.687 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 126.74 -70.95 0.49 Allowed Glycine 0 C--N 1.337 0.621 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.422 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 4.5 t 79.05 -174.7 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.225 0.536 . . . . 0.0 111.972 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.75 -153.06 0.3 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.081 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.575 ' HB3' ' CG ' ' B' ' 121' ' ' ASP . . . -52.44 -74.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.043 0.449 . . . . 0.0 110.677 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.11 63.91 0.61 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.866 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.69 165.69 17.47 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.172 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -144.22 150.66 38.32 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.973 0.416 . . . . 0.0 111.752 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' B' ' 170' ' ' LYS . 0.0 OUTLIER -128.41 121.28 28.68 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.842 179.402 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -60.58 145.41 48.9 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.275 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 80.2 m95 . . . . . 0 C--O 1.251 1.172 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.938 -179.708 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.486 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 O4'-C1'-C2' 106.848 0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.486 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C1'-O4'-C4' 110.295 0.425 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.468 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 104.641 1.386 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.405 " O4'" " H1'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.949 0 C4'-C3'-C2' 104.627 1.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.495 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C4'-C3'-C2' 104.704 1.504 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.506 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.664 0 C4'-C3'-C2' 104.555 1.355 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.596 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 104.899 1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.716 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 N19-C1'-C2' 115.72 0.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.716 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 O4'-C1'-C2' 107.229 1.026 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.62 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.771 0 C3'-C2'-C1' 105.61 2.079 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.62 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 N19-C1'-C2' 112.548 -1.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.472 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.597 -0.788 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 106.981 0.801 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 C1'-O4'-C4' 110.506 0.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 O4'-C1'-C2' 107.126 0.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.502 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 101.571 -0.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.797 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C4'-C3'-C2' 101.833 -1.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.797 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.857 0 C4'-C3'-C2' 104.32 1.12 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.699 ' H72' ' C5 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.977 0 C3'-C2'-C1' 101.416 -0.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.531 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.743 0 C3'-C2'-C1' 105.417 1.941 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.531 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.699 0 C4'-C3'-C2' 104.575 1.375 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.41 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C1'-O4'-C4' 110.597 0.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.444 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.979 0 C1'-O4'-C4' 106.841 -2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.463 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.526 0 C1'-O4'-C4' 110.909 0.864 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.426 ' C5 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 O4'-C1'-C2' 104.864 -1.124 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C1'-O4'-C4' 110.435 0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.484 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 66.2 mtm . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 1' ' ' MET . 2.0 mptp? 72.49 109.58 0.07 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.991 0.424 . . . . 0.0 110.451 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' B' ' 108' ' ' THR . 29.3 tp60 -104.2 107.38 18.26 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.219 0.533 . . . . 0.0 110.235 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 5.6 ttm180 -78.19 102.87 7.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.72 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.0 ' CD1' HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -108.1 127.19 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 177.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.798 HG23 ' H73' ' C' ' 178' ' ' ' DT' . 0.2 OUTLIER -129.73 127.77 41.11 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.81 -0.756 . . . . 0.0 112.529 -176.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.709 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.57 109.06 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.363 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' B' ' 102' ' ' LYS . 5.8 p -70.56 94.31 0.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.083 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.026 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.8 t -84.6 -132.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.827 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.675 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 3.8 t70 82.63 -10.32 1.07 Allowed 'General case' 0 C--N 1.35 0.627 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.1 m -128.4 -58.18 1.19 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.204 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' B' ' 129' ' ' SER . 1.3 m-20 -49.7 -101.96 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -177.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 36.02 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.558 -0.714 . . . . 0.0 110.701 -178.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.026 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.01 -39.15 23.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.303 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.12 -45.52 33.12 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -176.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.807 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -54.59 -47.32 73.49 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.943 0.792 . . . . 0.0 111.893 -179.615 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.848 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.82 -49.86 76.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.117 -179.461 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.5 OUTLIER -73.99 -26.06 60.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.299 178.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -65.38 -27.53 68.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.409 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.732 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.1 -42.19 12.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.468 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.6 21.34 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 176.287 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.6 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 61.7 t -156.71 94.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.597 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' ' HE1' ' B' ' 132' ' ' MET . 3.3 p30 -60.34 -93.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.079 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -148.61 3.08 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 179.072 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.626 ' HB2' ' OP1' ' D' ' 190' ' ' ' DG' . 4.1 t -38.03 -63.17 0.5 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.662 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.05 -29.99 18.63 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.507 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.728 ' HB3' HG22 ' A' ' 24' ' ' ILE . 13.0 tp -56.52 -61.97 2.05 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 117.282 0.541 . . . . 0.0 110.718 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.079 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.1 t -54.66 -57.09 7.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-O 121.774 0.797 . . . . 0.0 109.097 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.85 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 60.2 m -47.38 -49.84 23.71 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.802 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.5 OUTLIER -80.75 -47.4 13.99 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.78 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.34 -43.83 92.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.69 -179.321 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.049 ' HA ' HD12 ' B' ' 117' ' ' LEU . 5.6 mmt -54.01 -57.11 12.26 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.319 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -54.86 -36.97 65.66 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -52.88 22.03 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.919 ' HB3' HD11 ' B' ' 117' ' ' LEU . 1.6 tp10 -70.78 -25.31 62.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.408 178.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.748 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -81.88 -25.22 35.21 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 122.839 0.456 . . . . 0.0 110.747 178.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -79.66 -46.99 16.14 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 122.095 0.95 . . . . 0.0 108.835 178.05 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.524 ' C ' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -76.89 -46.36 24.73 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 113.233 -1.803 . . . . 0.0 113.172 -177.712 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.012 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 8.59 65.07 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.514 0.726 . . . . 0.0 112.935 -177.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 175.88 62.87 0.0 OUTLIER 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.322 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 179.23 159.79 0.68 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.613 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -69.37 51.34 0.1 Allowed 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 73.28 134.75 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.3 67.48 1.9 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.046 0.451 . . . . 0.0 109.991 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.418 ' NZ ' ' O ' ' B' ' 150' ' ' GLU . 3.7 pttt -87.02 151.82 22.93 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 30.5 m -121.09 122.71 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.139 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.15 -160.47 1.01 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.876 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 82.94 120.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.235 0.54 . . . . 0.0 111.742 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pm0 -171.52 125.48 0.61 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.296 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.89 -75.15 0.52 Allowed 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -178.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -178.64 73.79 0.07 OUTLIER Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.938 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.32 163.72 32.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.701 0.286 . . . . 0.0 110.62 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 85.2 t -99.31 -65.09 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.228 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -86.6 149.94 24.57 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.901 0.381 . . . . 0.0 111.486 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 55' ' ' VAL . 67.9 t -124.38 4.24 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.97 136.58 56.15 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.97 0.414 . . . . 0.0 111.611 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.2 mtt-85 -148.33 -65.67 0.24 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.409 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.463 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -154.5 -155.34 0.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.787 -179.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.463 ' HB ' ' O ' ' A' ' 58' ' ' PHE . 2.7 mp 77.38 100.98 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.941 0.4 . . . . 0.0 111.132 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.16 -42.71 83.86 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.347 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.4 mmt -61.58 121.77 13.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.884 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -45.19 130.18 7.9 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.77 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -72.14 92.74 0.57 Allowed Glycine 0 C--N 1.331 0.299 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.918 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.7 t 67.54 -150.92 0.18 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.489 0.185 . . . . 0.0 111.208 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.3 87.43 1.81 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.823 0.344 . . . . 0.0 111.692 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.408 ' HA ' HG21 ' A' ' 22' ' ' VAL . . . -139.76 -126.25 0.11 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.721 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -126.52 71.47 1.29 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.444 0.64 . . . . 0.0 111.246 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -94.98 48.67 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.653 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -65.05 -74.58 0.1 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.8 58.47 0.14 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 62.32 -70.76 0.05 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.597 ' CE3' ' HD2' ' B' ' 140' ' ' ARG . 1.1 t90 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.95 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 N-CA-C 111.348 0.129 . . . . 0.0 111.348 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 22.7 mmmt -104.05 -176.59 3.12 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.046 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.648 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -104.88 107.68 18.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.119 0.485 . . . . 0.0 111.014 179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.599 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.2 OUTLIER -78.59 106.97 10.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.856 0.836 . . . . 0.0 111.875 -178.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.754 HD11 HG11 ' B' ' 128' ' ' VAL . 1.4 pt -110.04 120.77 61.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.089 178.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.676 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.01 125.8 32.38 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -177.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 1.0 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.47 103.84 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 82.1 p -68.94 90.15 0.43 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.192 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.1 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.2 t -79.22 -134.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.296 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 35.3 t70 90.54 -5.74 0.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 121.711 0.767 . . . . 0.0 109.192 -176.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -134.61 -59.37 0.81 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.156 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.85 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 1.5 m-20 -47.98 -95.03 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.578 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 1.2 m -177.93 35.0 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.362 -0.836 . . . . 0.0 111.404 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.1 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -80.6 -43.97 19.7 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.645 0.778 . . . . 0.0 111.269 179.302 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.702 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 81.8 mt-30 -49.81 -38.29 34.01 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.68 -177.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.748 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -57.27 -56.52 20.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.528 0.603 . . . . 0.0 112.211 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 1.049 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -54.6 -40.07 68.51 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.733 -178.29 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.24 -32.3 43.79 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.458 0.647 . . . . 0.0 110.938 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.556 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -62.98 -28.88 70.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.611 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.012 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -88.02 -46.28 9.47 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.661 178.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 3.2 t0 165.87 12.72 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.447 ' O ' HD22 ' B' ' 117' ' ' LEU . 72.7 t -153.69 91.99 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-N 118.783 0.719 . . . . 0.0 112.014 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 1.0 OUTLIER -59.3 -102.36 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.012 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.37 4.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 179.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.439 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -44.41 -64.03 0.77 Allowed 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.327 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.463 ' HA2' ' OG ' ' B' ' 129' ' ' SER . . . -86.1 -29.74 24.72 Favored Glycine 0 C--N 1.337 0.631 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.071 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.682 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.4 -61.38 2.37 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 122.342 0.257 . . . . 0.0 110.649 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.999 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -54.64 -61.88 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.641 0 CA-C-O 121.347 0.594 . . . . 0.0 110.103 178.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.874 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 9.0 p -47.99 -44.05 30.32 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -78.65 -47.79 16.34 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.447 0.567 . . . . 0.0 109.972 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.433 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 3.2 m -60.13 -47.69 84.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.322 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.848 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 4.5 mmt -54.64 -53.63 52.28 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 116.769 -0.196 . . . . 0.0 110.484 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -49.39 -40.11 34.86 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -69.75 -48.99 57.37 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 121.367 -0.133 . . . . 0.0 110.911 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -74.66 -13.57 60.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.914 0.388 . . . . 0.0 110.214 178.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.807 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.75 -48.52 7.78 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -51.6 -54.53 26.69 Favored 'General case' 0 CA--C 1.5 -0.97 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.266 178.701 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -82.01 -50.1 9.5 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.505 -178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 47.24 76.07 0.11 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 179.12 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.597 ' HD2' ' CE3' ' A' ' 72' ' ' TRP . 0.2 OUTLIER 168.36 159.34 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 178.382 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -82.77 126.58 32.57 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.844 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' B' ' 143' ' ' ARG . 18.5 tt0 -163.45 160.08 22.94 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.683 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.462 ' C ' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 8.66 89.6 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 179.535 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.445 ' C ' ' HG3' ' B' ' 145' ' ' LYS . 9.7 p-90 -74.7 39.36 0.13 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.445 ' HG3' ' C ' ' B' ' 144' ' ' TRP . 0.0 OUTLIER 163.1 152.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.687 0.795 . . . . 0.0 110.081 179.355 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 33.2 m -101.74 162.13 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -140.15 34.21 1.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.051 0.453 . . . . 0.0 111.378 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -137.03 -166.35 1.9 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.664 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -76.46 -87.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.534 0.207 . . . . 0.0 111.51 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . 0.418 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 4.0 tp10 -163.4 -56.9 0.04 OUTLIER 'General case' 0 C--O 1.239 0.527 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.241 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 138.81 -162.39 25.88 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.742 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -147.18 68.06 1.15 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.184 0.516 . . . . 0.0 111.135 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.479 HG22 ' H ' ' B' ' 154' ' ' GLU . 2.2 p -171.58 170.09 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.001 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.479 ' H ' HG22 ' B' ' 153' ' ' VAL . 0.0 OUTLIER -127.97 149.55 50.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.923 0.392 . . . . 0.0 110.807 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.474 ' CG2' ' CZ2' ' B' ' 172' ' ' TRP . 3.3 m -147.65 40.82 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 121.37 0.605 . . . . 0.0 111.326 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.4 -159.13 0.18 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.078 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.94 156.39 22.33 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.779 0.323 . . . . 0.0 111.092 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.448 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 44.8 m-85 -91.68 -160.4 0.73 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.992 179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 44.1 mt 74.33 -64.94 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.98 77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.295 0.569 . . . . 0.0 111.875 -179.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.6 ptm -161.37 76.49 0.53 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.901 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -135.01 -66.66 0.57 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.363 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -77.74 -0.14 73.23 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.692 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 5.3 t 79.3 179.57 0.11 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.911 0.355 . . . . 0.0 111.213 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.654 ' CG ' ' HB3' ' B' ' 168' ' ' GLU . 0.3 OUTLIER -172.24 114.73 0.32 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.404 -179.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -67.66 -28.41 67.68 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -95.83 -52.53 4.04 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.654 ' HB3' ' CG ' ' B' ' 165' ' ' PHE . 12.1 tp10 -48.63 104.38 0.06 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.094 0.473 . . . . 0.0 111.308 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -71.32 -22.92 61.86 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? 70.22 -59.36 0.52 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.544 0.211 . . . . 0.0 111.394 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.44 ' O ' ' CB ' ' B' ' 172' ' ' TRP . 1.1 m-20 -64.47 -18.2 64.55 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.607 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.474 ' CZ2' ' CG2' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.256 0 C-N-CA 123.608 0.763 . . . . 0.0 109.998 -179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.488 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C3'-C2'-C1' 101.764 -0.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.553 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 N19-C1'-C2' 115.266 0.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.553 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 O4'-C1'-C2' 107.381 1.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.417 ' C7 ' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.925 0 C4'-C3'-C2' 104.634 1.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.689 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.022 0 C3'-C2'-C1' 104.87 1.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.798 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 C2'--C1' 1.511 -0.699 0 O4'-C1'-C2' 104.923 -1.07 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.919 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 106.198 2.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.919 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 N19-C1'-C2' 114.948 0.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.666 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 104.489 1.278 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.653 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.765 0 C3'-C2'-C1' 105.548 2.034 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.653 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-C2' 106.917 0.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.582 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.146 0.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . 0.44 ' C2 ' ' C6 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C5'-C4'-O4' 108.767 -0.396 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 C3'-C2'-C1' 101.946 -0.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.633 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.549 0 O4'-C1'-C2' 106.866 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.633 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.538 0 C4'-C3'-C2' 103.977 0.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.442 H2'' ' OP2' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C4'-C3'-C2' 102.34 -0.86 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.626 ' OP1' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C3'-C2'-C1' 105.896 2.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.545 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C4'-C3' 104.492 -1.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.527 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.788 0 C1'-O4'-C4' 110.807 0.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.599 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.41 -0.794 0 C3'-C2'-C1' 104.971 1.622 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.475 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 O4'-C1'-C2' 107.127 0.934 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.475 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.939 0 C1'-O4'-C4' 107.581 -1.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.292 1.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.536 0.798 0 O4'-C1'-C2' 105.151 -0.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C1'-O4'-C4' 110.26 0.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 ttp . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 -174.04 4.77 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.581 0.229 . . . . 0.0 110.982 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.661 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 4.2 tt0 -124.23 121.8 36.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.584 0.707 . . . . 0.0 111.771 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.889 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.7 ttp-105 -79.81 113.25 17.82 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.069 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.813 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -103.4 124.35 57.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.65 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.645 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -129.99 123.61 31.01 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.434 -0.906 . . . . 0.0 111.844 -177.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.877 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.67 108.46 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.9 p -70.9 89.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.04 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.1 t -86.41 -132.31 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 119.106 -0.473 . . . . 0.0 111.985 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.9 t70 82.4 -8.82 1.21 Allowed 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -175.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -130.1 -63.23 0.91 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.119 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.713 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.72 -89.84 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.9 t 176.53 39.55 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 121.705 0.764 . . . . 0.0 110.772 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.04 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.71 -44.25 14.67 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.877 -179.251 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.623 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -47.53 -37.9 13.04 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -175.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.81 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.83 -56.6 19.27 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 118.721 0.692 . . . . 0.0 112.458 -179.628 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.919 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.65 -43.87 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.457 0.646 . . . . 0.0 111.378 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.738 ' HB3' ' HB3' ' A' ' 23' ' ' ASN . 4.2 pttt -79.65 -30.95 41.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.605 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.34 -29.05 67.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.873 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.926 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.12 -46.55 9.2 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.693 -0.67 . . . . 0.0 109.463 178.459 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 154.83 19.72 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 176.125 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.657 ' O ' HD12 ' A' ' 17' ' ' LEU . 75.0 t -156.58 84.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 118.165 0.438 . . . . 0.0 111.678 -178.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.738 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -58.08 -96.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.067 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -138.98 -3.71 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 115.664 1.728 . . . . 0.0 115.664 -179.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.55 ' HB3' ' OP2' ' D' ' 190' ' ' ' DG' . 78.3 p -39.05 -64.23 0.47 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-N 119.057 0.844 . . . . 0.0 109.501 -179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.468 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -85.22 -29.99 26.46 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.65 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 4.9 tp -58.64 -61.98 2.2 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.875 0.338 . . . . 0.0 110.83 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.067 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.03 -67.25 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.944 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.65 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 90.9 p -48.45 -36.76 15.64 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -78.47 -45.93 20.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.556 0.616 . . . . 0.0 109.595 178.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.544 ' OG1' HG21 ' B' ' 131' ' ' THR . 20.9 m -64.0 -50.02 70.18 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.65 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.72 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 2.6 mmt -50.96 -43.13 60.33 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.849 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.448 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -61.21 -48.92 79.27 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -47.47 85.4 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.861 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -64.75 -38.63 91.64 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.57 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.598 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.11 -47.27 85.87 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -51.91 67.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 39' ' ' LEU . 6.2 mmt180 -52.97 -49.93 65.12 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.925 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.92 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER -16.86 108.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.328 1.051 . . . . 0.0 113.2 179.681 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -141.35 -55.93 0.48 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.88 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.47 153.5 17.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.36 178.79 6.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.922 0.392 . . . . 0.0 111.808 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.688 ' HA ' ' NH1' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -164.74 -80.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.405 178.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.483 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 161.03 -59.86 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.392 0.677 . . . . 0.0 110.362 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.535 ' CE ' HG12 ' A' ' 46' ' ' VAL . 0.0 OUTLIER 72.14 119.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.596 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.535 HG12 ' CE ' ' A' ' 45' ' ' LYS . 14.6 p -51.87 129.02 11.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 121.127 0.489 . . . . 0.0 111.542 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -78.93 115.49 18.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.541 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -169.94 145.18 2.88 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.968 0.413 . . . . 0.0 111.506 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.56 103.7 12.87 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.197 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.63 155.14 25.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 120.907 0.384 . . . . 0.0 111.625 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 174.16 126.9 0.95 Allowed Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.488 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.8 mtt -106.06 145.99 30.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.793 0.33 . . . . 0.0 111.304 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.451 HG12 ' N ' ' A' ' 54' ' ' GLU . 21.9 t -83.4 158.24 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.608 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.632 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.7 pt-20 36.94 55.18 1.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.444 0.64 . . . . 0.0 112.478 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.518 HG22 ' CB ' ' A' ' 72' ' ' TRP . 8.0 m -89.29 74.93 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.177 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.425 ' O ' ' N ' ' A' ' 58' ' ' PHE . . . -110.5 -85.28 0.55 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.959 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 56.87 -79.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.711 0.405 . . . . 0.0 111.818 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -143.92 75.4 1.47 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.108 0.48 . . . . 0.0 110.32 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.7 tt -112.12 84.12 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.251 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -115.5 143.94 44.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.232 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.456 ' HG3' ' HD2' ' B' ' 140' ' ' ARG . 5.9 mmt -159.11 75.78 0.69 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -67.99 64.64 0.09 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.342 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 162.53 95.75 0.11 Allowed Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.94 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.4 p -84.48 158.94 20.85 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.836 0.35 . . . . 0.0 111.346 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -105.78 -41.04 5.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.232 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -130.73 -71.83 0.57 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.038 0.447 . . . . 0.0 110.636 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -112.09 -160.47 0.72 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.93 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.46 -156.9 0.6 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.272 0.229 . . . . 0.0 110.582 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.441 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -156.86 119.6 4.02 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.122 0.487 . . . . 0.0 111.953 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.441 ' NZ ' ' O ' ' A' ' 69' ' ' ASN . 20.8 mmtm -136.08 151.88 50.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.619 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 64.86 179.64 0.18 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.411 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.632 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.739 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 111.356 0.132 . . . . 0.0 111.356 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 9' ' ' VAL . 5.3 mmpt? -73.83 -179.49 3.7 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.094 0.246 . . . . 0.0 110.954 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 9' ' ' VAL . 26.9 tp60 -114.01 115.25 27.32 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.942 0.401 . . . . 0.0 111.887 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.428 ' NH1' ' HG3' ' B' ' 104' ' ' ARG . 5.9 ttm-85 -78.42 109.18 12.35 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.876 0.846 . . . . 0.0 111.773 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.81 HD11 HG11 ' B' ' 128' ' ' VAL . 0.8 OUTLIER -108.16 127.31 64.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 113.993 -1.458 . . . . 0.0 107.115 177.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.645 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.46 129.86 41.73 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -177.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.896 HG12 HD13 ' A' ' 24' ' ' ILE . 1.1 m -101.57 99.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 173.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.889 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -70.76 67.48 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.793 -0.763 . . . . 0.0 111.782 -177.695 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.851 HG22 HG22 ' B' ' 107' ' ' VAL . 3.8 m -99.67 -114.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 10.0 t0 145.74 -84.82 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -88.19 2.84 51.3 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 118.974 -0.536 . . . . 0.0 112.134 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.65 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -76.14 62.26 1.68 Allowed 'General case' 0 C--N 1.357 0.93 0 CA-C-N 119.588 1.085 . . . . 0.0 108.73 179.419 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.653 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.5 OUTLIER 59.55 -25.58 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.813 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -44.49 -62.19 1.27 Allowed 'General case' 0 C--N 1.348 0.534 0 C-N-CA 123.352 0.661 . . . . 0.0 111.411 -179.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.576 ' N ' ' CG ' ' B' ' 114' ' ' TYR . 2.6 pp0? -49.45 -33.59 14.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.58 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.598 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -60.4 -50.18 74.61 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.861 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -52.53 -51.97 57.05 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.695 0.759 . . . . 0.0 111.557 -179.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.683 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -73.47 -29.02 62.26 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.193 179.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.54 -25.72 68.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.607 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.92 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -87.78 -41.0 13.59 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 118.608 -0.711 . . . . 0.0 109.804 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 158.68 39.04 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 177.057 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.635 ' O ' HG13 ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.1 94.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.885 ' O ' HD12 ' B' ' 124' ' ' ILE . 59.1 m-80 -67.3 71.01 0.11 Allowed 'General case' 0 N--CA 1.462 0.128 0 O-C-N 121.599 -0.688 . . . . 0.0 109.584 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.885 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.3 OUTLIER 37.59 -10.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.877 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.84 -55.99 1.14 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 120.002 1.274 . . . . 0.0 110.52 -176.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.547 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.16 -30.42 28.31 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.311 178.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.753 HD12 ' CG2' ' B' ' 124' ' ' ILE . 1.7 tm? -60.88 -61.26 2.71 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.952 0.376 . . . . 0.0 110.687 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.811 HG23 ' CG2' ' B' ' 124' ' ' ILE . 41.4 t -50.68 -64.19 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.713 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 24.7 p -50.42 -48.7 56.08 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.0 OUTLIER -62.92 -50.92 68.94 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.544 HG21 ' OG1' ' A' ' 31' ' ' THR . 23.4 m -58.01 -42.69 85.78 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.06 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.919 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -59.19 -57.26 13.82 Favored 'General case' 0 C--O 1.209 -1.071 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.403 179.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.9 OUTLIER -49.1 -41.67 36.49 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.606 179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -51.91 54.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.602 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.864 ' HB3' HD21 ' A' ' 17' ' ' LEU . 8.9 tp10 -74.73 -14.57 60.74 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.684 0.278 . . . . 0.0 110.613 178.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.81 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.63 -38.02 16.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 123.211 0.604 . . . . 0.0 110.994 179.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -71.84 -53.45 13.24 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.835 0.826 . . . . 0.0 110.312 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.524 ' HD3' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -84.67 -41.63 16.11 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 113.969 -1.469 . . . . 0.0 113.62 -177.958 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.926 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 40.8 32.78 0.17 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.783 0.433 . . . . 0.0 111.356 -177.192 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.498 ' HG2' ' N ' ' B' ' 141' ' ' ALA . 15.9 ttp85 -179.74 151.98 0.47 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.322 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.498 ' N ' ' HG2' ' B' ' 140' ' ' ARG . . . -58.39 129.11 40.49 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.384 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.02 175.62 10.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.402 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -166.03 -64.09 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.41 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.46 ' HE3' ' HA ' ' B' ' 144' ' ' TRP . 0.0 OUTLIER 62.54 -81.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 179.444 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.04 -45.4 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.51 ' O ' HG13 ' B' ' 146' ' ' VAL . 7.6 p -76.81 90.34 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-O 121.344 0.592 . . . . 0.0 110.961 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -105.69 99.53 9.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.433 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.3 78.64 1.14 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.01 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -179.61 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.548 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -117.53 -140.74 0.36 Allowed 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.93 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 67.04 -78.29 0.15 Allowed Glycine 0 C--N 1.341 0.835 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.567 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.564 ' SD ' HG11 ' B' ' 155' ' ' VAL . 8.8 mmt 70.56 99.12 0.06 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 122.756 0.422 . . . . 0.0 111.709 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.554 HG23 ' H ' ' B' ' 154' ' ' GLU . 4.6 m -120.6 -59.13 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.714 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.554 ' H ' HG23 ' B' ' 153' ' ' VAL . 0.6 OUTLIER -92.44 -61.45 1.6 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.67 0.272 . . . . 0.0 110.795 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.751 ' HA ' ' CB ' ' B' ' 172' ' ' TRP . 10.3 m 41.51 36.54 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.7 119.5 24.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.255 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -145.67 -78.95 0.18 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.563 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -127.43 -56.2 1.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 45.5 mm -111.68 133.19 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.886 0.374 . . . . 0.0 111.037 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.84 70.6 9.55 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.508 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.5 mmt -138.9 115.57 10.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.441 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -74.8 58.59 0.83 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.998 0.427 . . . . 0.0 111.768 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -156.87 69.55 0.28 Allowed Glycine 0 C--N 1.332 0.358 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.387 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.1 p -162.8 78.7 0.47 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.619 0.247 . . . . 0.0 111.122 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -157.18 78.2 0.88 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 39' ' ' LEU . . . -95.09 -108.15 0.14 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -65.71 -48.35 72.27 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.282 0.563 . . . . 0.0 109.498 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -117.65 128.78 55.25 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.661 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -71.4 -87.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.058 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.531 ' O ' ' HA ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -170.87 -101.12 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.485 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -157.43 -55.94 0.08 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.635 0.255 . . . . 0.0 110.511 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.751 ' CB ' ' HA ' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.921 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-C2' 107.146 0.951 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.925 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.545 0 C4'-C3'-C2' 101.671 -1.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.925 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 C3'-C2'-C1' 105.494 1.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.543 ' C6 ' " C2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.76 0 C4'-C3'-C2' 104.526 1.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.621 " H2'" ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.001 0 C3'-C2'-C1' 105.27 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.621 ' H72' " H2'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 C4'-C3'-C2' 104.255 1.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.569 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.761 0 C3'-C2'-C1' 106.416 2.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.569 ' H72' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C3'-C2'-C1' 102.128 -0.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.432 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C1'-C2' 107.154 0.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.591 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.854 0 C3'-C2'-C1' 105.056 1.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-C2' 107.174 0.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.576 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.173 0.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . 0.459 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C1'-O4'-C4' 110.42 0.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.457 ' H71' " H2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 107.268 1.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.554 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.111 0.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.806 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 C1'-O4'-C4' 110.547 0.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.841 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 P--O5' 1.597 0.373 0 C1'-O4'-C4' 110.833 0.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.55 ' OP2' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.002 0 C4'-C3'-C2' 104.74 1.54 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.618 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 105.239 1.814 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.485 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.695 0 C3'-C2'-C1' 105.846 2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.485 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C4'-C3'-C2' 104.603 1.403 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.47 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C1'-O4'-C4' 110.706 0.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.47 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.048 0 C1'-O4'-C4' 107.748 -1.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.559 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 O4'-C1'-C2' 106.991 0.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.559 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.792 0 C4'-C3'-C2' 104.186 0.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C1'-O4'-C4' 110.285 0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.532 0.206 . . . . 0.0 111.539 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.594 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 20.7 mmtm -148.15 143.02 26.81 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.746 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.654 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -112.85 114.54 27.11 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 120.927 0.394 . . . . 0.0 111.449 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.9 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.49 104.67 10.26 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 120.156 -0.618 . . . . 0.0 110.824 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.86 HD13 ' CD1' ' B' ' 114' ' ' TYR . 1.4 pt -109.41 127.92 65.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.869 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.9 141.74 48.54 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 117.955 -1.498 . . . . 0.0 113.316 -178.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 1.049 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.41 102.39 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.525 -1.216 . . . . 0.0 109.16 177.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.956 HG23 HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -70.18 76.92 0.52 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.815 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.2 p -110.67 -128.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.907 -176.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.808 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 5.3 t70 94.76 23.52 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 122.841 1.305 . . . . 0.0 109.399 -175.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 9' ' ' VAL . 12.3 t -150.24 -50.47 0.13 Allowed 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 112.746 -2.025 . . . . 0.0 110.486 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.715 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 5.6 m-20 -79.16 46.3 0.7 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.465 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 68.9 m 66.82 9.77 7.03 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.815 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -60.75 -50.74 72.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.969 1.258 . . . . 0.0 111.001 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 14.3 mm-40 -48.95 -32.46 9.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.735 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -64.81 -56.49 13.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.277 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.768 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.29 -56.08 8.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.275 0.559 . . . . 0.0 112.187 -178.306 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 15' ' ' GLN . 5.1 pttp -69.21 -25.98 64.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.491 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.13 -26.74 65.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.07 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.958 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -87.54 -38.57 15.89 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.725 -0.655 . . . . 0.0 109.664 178.812 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 156.69 25.04 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 177.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 24' ' ' ILE . 54.4 t -147.89 82.87 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 3.0 m-20 -64.65 63.79 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.939 0.4 . . . . 0.0 110.593 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.987 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 40.96 -13.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 118.258 2.688 . . . . 0.0 118.258 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.539 ' N ' ' O ' ' A' ' 23' ' ' ASN . 10.1 t -38.25 -61.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 119.862 1.21 . . . . 0.0 110.337 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.487 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -78.89 -36.13 29.38 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.031 178.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.546 HD13 HD11 ' A' ' 17' ' ' LEU . 7.9 tp -56.58 -61.87 2.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.766 0.317 . . . . 0.0 110.183 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.119 HG22 HG22 ' B' ' 128' ' ' VAL . 2.7 t -50.21 -64.52 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.176 178.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.685 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 26.5 p -49.36 -45.34 45.69 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -70.06 -42.94 72.17 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.583 HG21 ' OG1' ' B' ' 131' ' ' THR . 35.2 m -61.49 -42.78 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.038 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.853 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.4 mmt -50.27 -50.67 49.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.981 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.505 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.42 -45.15 95.52 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.145 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.505 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.74 -52.59 59.79 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.722 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 1.044 ' HG2' HD11 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -61.61 -37.1 82.7 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.154 178.714 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.852 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -66.23 -38.94 89.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.704 178.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -73.2 -56.1 5.56 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.397 0.618 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.29 -36.6 39.43 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.183 -177.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.223 HD11 ' CE2' ' B' ' 120' ' ' TYR . 61.1 mt 33.02 -104.31 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.202 0.601 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 35.3 ttt85 60.2 21.78 11.12 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 178.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 72.58 162.12 0.25 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.332 0.587 . . . . 0.0 112.308 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -92.23 172.12 8.63 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.51 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.731 ' CZ ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -119.66 136.96 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.922 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.46 156.06 33.36 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.906 0.384 . . . . 0.0 111.149 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -55.53 123.31 13.55 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.291 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.8 157.13 4.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-O 120.988 0.423 . . . . 0.0 110.987 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -71.71 146.76 47.98 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.585 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.31 -52.84 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.152 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 67.58 59.69 0.48 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.049 0.452 . . . . 0.0 111.597 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 57.51 39.73 27.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.202 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 175.75 166.7 33.64 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.128 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 33.6 mtm 57.1 61.94 2.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.865 0.364 . . . . 0.0 111.966 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.63 HG22 ' HG2' ' A' ' 54' ' ' GLU . 8.0 p -163.0 146.86 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.717 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 0.0 OUTLIER 49.67 -173.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.731 179.455 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.65 HG23 ' CE2' ' A' ' 72' ' ' TRP . 0.6 OUTLIER -139.65 -71.94 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.865 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 60.49 122.79 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -174.74 142.84 0.73 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 36.6 t80 70.84 -51.7 0.68 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -72.45 126.68 33.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.042 0.449 . . . . 0.0 111.974 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.26 149.75 24.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.074 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.506 ' O ' HG12 ' B' ' 146' ' ' VAL . 0.0 OUTLIER -122.91 -20.65 5.76 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.748 ' HA ' ' HB2' ' A' ' 68' ' ' GLU . 2.8 p30 -52.88 159.39 1.15 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.429 0.633 . . . . 0.0 112.672 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.907 ' HA3' HG13 ' B' ' 146' ' ' VAL . . . 167.39 -22.44 0.11 Allowed Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.527 -0.76 . . . . 0.0 114.353 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 95.8 p -171.55 -179.71 2.63 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 117.983 0.891 . . . . 0.0 112.25 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 70.67 28.16 3.55 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.177 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 53.49 24.4 4.02 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.439 ' OD2' ' HA ' ' B' ' 139' ' ' LEU . 20.9 t70 -173.63 -141.9 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.916 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.748 ' HB2' ' HA ' ' A' ' 62' ' ' ASN . 2.2 pt-20 -170.11 148.12 3.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.111 0.481 . . . . 0.0 111.513 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.614 ' HA ' ' HG3' ' B' ' 135' ' ' GLU . 2.2 t-20 -83.2 -158.82 0.31 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.902 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 61' ' ' MET . 22.9 mttt -101.09 172.52 6.96 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.495 0.664 . . . . 0.0 112.663 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -115.64 -35.87 4.41 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.533 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.908 ' CZ3' HG21 ' B' ' 153' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.398 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.35 175.73 8.89 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.557 0.218 . . . . 0.0 110.781 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.808 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 2.9 tt0 -122.49 119.88 32.24 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.076 0.465 . . . . 0.0 111.725 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.956 HH11 HG23 ' A' ' 8' ' ' THR . 9.9 ttt85 -79.64 117.95 21.02 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.795 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.831 HD11 HG11 ' B' ' 128' ' ' VAL . 0.5 OUTLIER -111.07 116.64 53.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.741 -179.656 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.869 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.11 126.06 54.21 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -176.26 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 107' ' ' VAL . 0.2 OUTLIER -100.86 85.78 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 175.425 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.9 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -56.03 98.39 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -179.655 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.998 HG11 ' CB ' ' B' ' 114' ' ' TYR . 14.9 p -110.36 -137.75 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.562 -175.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.747 ' H ' HG22 ' B' ' 109' ' ' VAL . 31.1 t70 89.14 -7.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -174.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.61 -65.51 1.14 Allowed 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.313 -1.312 . . . . 0.0 107.912 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.685 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -38.72 -84.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.244 0.34 . . . . 0.0 111.26 179.621 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.3 OUTLIER 173.9 45.86 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 121.123 0.487 . . . . 0.0 110.937 179.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.998 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.7 OUTLIER -83.35 -40.86 18.89 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.623 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.82 -40.59 21.54 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.852 HD22 ' HB1' ' A' ' 36' ' ' ALA . 1.4 mt -50.33 -33.48 20.38 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -78.4 -51.11 10.54 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.522 0.677 . . . . 0.0 111.648 178.705 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.623 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -70.46 -25.88 63.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.35 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.45 -27.85 50.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.019 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.223 ' CE2' HD11 ' A' ' 39' ' ' LEU . 2.8 m-30 -88.47 -40.75 13.23 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.303 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.3 t0 115.31 57.74 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.155 0.978 . . . . 0.0 111.547 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' B' ' 124' ' ' ILE . 92.0 t -118.34 -19.86 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.043 -179.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.612 ' O ' HD12 ' B' ' 124' ' ' ILE . 36.0 m-20 41.38 23.25 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.799 0.333 . . . . 0.0 111.562 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.874 HG22 HD22 ' B' ' 127' ' ' LEU . 2.4 pp 21.99 45.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 177.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.766 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 p -62.97 -63.72 1.12 Allowed 'General case' 0 C--N 1.291 -1.953 0 CA-C-O 121.938 0.875 . . . . 0.0 110.813 176.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.443 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -81.15 -16.56 74.11 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.769 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 1.044 HD11 ' HG2' ' A' ' 35' ' ' GLU . 1.9 tp -66.82 -52.91 38.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.73 0.265 . . . . 0.0 111.235 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.119 HG22 HG22 ' A' ' 28' ' ' VAL . 35.0 t -53.57 -67.69 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.719 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.6 p -50.8 -36.64 38.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -63.06 -51.68 65.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.583 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.8 m -58.22 -31.73 67.63 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.081 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 14' ' ' TYR . 5.4 mmt -65.54 -54.71 24.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.482 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -49.94 -41.53 46.56 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.19 -54.0 44.42 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 116.833 -0.167 . . . . 0.0 110.749 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.1 mt-10 -75.08 -8.84 57.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.551 178.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -79.47 -47.31 15.85 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.224 -1.399 . . . . 0.0 107.224 176.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.9 74.54 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.398 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' B' ' 139' ' ' LEU . 7.7 tpt180 -63.44 -42.12 98.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.219 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.958 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -16.66 116.73 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.936 0.894 . . . . 0.0 113.059 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -156.71 -62.88 0.1 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.134 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -164.91 163.99 20.87 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.011 0.434 . . . . 0.0 111.751 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.442 ' O ' ' NH1' ' B' ' 143' ' ' ARG . 1.9 pm0 -96.18 -173.67 2.87 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.978 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.442 ' NH1' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -176.12 -152.29 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 178.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.434 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 1.3 p90 -147.1 143.19 28.12 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.713 0.292 . . . . 0.0 111.688 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 80.59 105.23 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.128 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.907 HG13 ' HA3' ' A' ' 63' ' ' GLY . 0.2 OUTLIER -121.07 121.67 65.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.829 179.243 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -14.23 49.83 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.9 m120 65.15 45.64 2.95 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.071 0.462 . . . . 0.0 111.619 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.65 120.41 42.14 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . 0.501 ' HG3' ' OD1' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -83.07 172.6 12.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.535 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -70.58 176.85 34.75 Favored Glycine 0 CA--C 1.522 0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.812 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -166.97 55.36 0.08 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.941 0.401 . . . . 0.0 111.995 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.908 HG21 ' CZ3' ' A' ' 72' ' ' TRP . 4.4 p -113.58 88.15 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 121.118 0.485 . . . . 0.0 111.021 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.777 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.433 HG22 ' O ' ' B' ' 155' ' ' VAL . 11.8 p -159.37 45.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.539 0.685 . . . . 0.0 111.155 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.05 -152.43 0.24 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.424 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.22 174.42 1.33 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.716 0.293 . . . . 0.0 110.862 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -63.99 95.45 0.12 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.943 0.402 . . . . 0.0 111.452 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.489 HG23 ' O ' ' B' ' 159' ' ' ILE . 3.4 tp -163.98 55.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.319 0.581 . . . . 0.0 111.298 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -164.7 159.52 18.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 9.7 mtt -65.36 86.07 0.07 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.049 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -75.58 165.76 24.59 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.124 0.488 . . . . 0.0 112.062 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 142.36 -136.71 7.38 Favored Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.257 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' B' ' 165' ' ' PHE . 38.3 t 61.0 -149.96 0.41 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.438 ' N ' ' OG ' ' B' ' 164' ' ' SER . 90.9 t80 -133.22 -54.54 0.91 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -122.53 -96.72 0.46 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.507 ' OD1' ' HB3' ' A' ' 39' ' ' LEU . 6.6 t0 -87.25 93.17 9.31 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.244 0.545 . . . . 0.0 111.503 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.407 ' HB3' ' CB ' ' B' ' 164' ' ' SER . 8.9 tt0 -169.59 92.27 0.24 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.388 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.447 ' O ' ' HB1' ' A' ' 41' ' ' ALA . 2.3 t30 -173.15 -168.35 0.46 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.772 0.32 . . . . 0.0 111.614 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -167.18 92.53 0.42 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.127 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -96.01 -83.68 0.37 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.966 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.363 -0.827 . . . . 0.0 111.82 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.781 " H1'" " O4'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.527 0.873 0 C3'-C2'-C1' 105.538 2.027 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.781 " O4'" " H1'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.526 0.791 0 C3'-C2'-C1' 106.067 2.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.491 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C4'-C3'-C2' 104.203 1.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.575 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.949 0 C1'-O4'-C4' 107.527 -1.552 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.669 " H2'" ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -1.027 0 C3'-C2'-C1' 105.382 1.916 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.705 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C4'-C3'-C2' 104.348 1.148 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.705 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.741 0 C3'-C2'-C1' 105.582 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.656 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.301 0.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.462 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.703 0 C3'-C2'-C1' 104.249 1.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.504 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.794 0 C3'-C2'-C1' 105.306 1.862 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 N19-C1'-C2' 113.272 -0.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.455 ' C5 ' ' C2 ' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 O4'-C4'-C3' 106.116 0.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 107.459 1.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.484 H5'' ' C5 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 N19-C1'-C2' 116.251 1.282 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.491 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 C3'-C2'-C1' 101.61 -0.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.491 ' C8 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.622 0 O4'-C1'-C2' 106.872 0.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.468 ' P ' ' HD2' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C4'-C3'-C2' 104.281 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.503 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.909 0 C1'-O4'-C4' 107.016 -1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.715 " H3'" ' O ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.603 0 C3'-C2'-C1' 105.139 1.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.349 1.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.632 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.746 0 C3'-C2'-C1' 105.606 2.076 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.632 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 C3'-C2'-C1' 104.599 1.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.529 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.879 0 C4'-C3'-C2' 104.573 1.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.447 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.498 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.737 0 O4'-C1'-C2' 104.807 -1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C1'-O4'-C4' 110.32 0.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.475 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 120.772 0.32 . . . . 0.0 111.478 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER 73.74 115.02 0.06 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.717 -179.511 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' B' ' 109' ' ' VAL . 1.2 tt0 -95.89 106.56 18.72 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.446 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.892 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.7 OUTLIER -78.87 99.86 6.94 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.738 -179.486 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.806 ' CG1' HD11 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -102.96 110.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 177.426 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.77 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.5 123.65 47.96 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 -175.645 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.647 HG22 ' CG2' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -100.16 105.66 17.96 Favored 'Isoleucine or valine' 0 C--N 1.344 0.337 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 176.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.635 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 2.0 p -70.08 90.46 0.65 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.028 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.1 t -78.08 -125.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.754 -177.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.585 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.6 t70 86.28 -5.34 0.76 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.292 0.568 . . . . 0.0 110.316 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.8 t -144.92 -52.0 0.28 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.335 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.794 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -44.78 -90.89 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.623 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' B' ' 129' ' ' SER . 1.6 m 177.85 34.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.392 -0.818 . . . . 0.0 111.133 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.028 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -84.05 -46.1 12.36 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.032 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.569 ' HA ' ' HG2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.12 -42.28 28.79 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.977 -176.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.89 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -60.29 -57.92 10.73 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.556 0.616 . . . . 0.0 111.82 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.093 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -60.34 -35.76 76.4 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.633 -178.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.784 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.74 -32.13 41.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.373 0.606 . . . . 0.0 112.117 -179.522 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.616 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -82.1 -16.88 48.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.267 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.008 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -87.98 -33.32 18.45 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.212 179.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' A' ' 67' ' ' ASP . 0.5 OUTLIER 172.88 -19.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.784 ' O ' ' HA ' ' A' ' 18' ' ' LYS . 17.0 t -97.19 -179.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.255 0.55 . . . . 0.0 110.168 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.053 ' O ' HD12 ' A' ' 24' ' ' ILE . 20.8 m120 -160.67 43.94 0.19 Allowed 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 177.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.053 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.96 -4.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 113.022 -1.899 . . . . 0.0 115.921 -177.45 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.607 ' OG ' " H4'" ' D' ' 189' ' ' ' DG' . 1.4 t -39.02 -63.79 0.5 Allowed 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.09 0.859 . . . . 0.0 109.675 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.587 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -86.76 -25.36 35.39 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.941 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.821 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -59.49 -62.36 1.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 117.438 0.619 . . . . 0.0 110.279 179.623 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.797 HG22 HG21 ' B' ' 124' ' ' ILE . 16.2 t -50.59 -59.26 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.787 0.804 . . . . 0.0 109.383 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 1.4 t -50.12 -52.58 33.85 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.0 OUTLIER -74.14 -50.96 17.12 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 117.762 0.255 . . . . 0.0 110.435 -177.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.579 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -54.17 -49.16 69.93 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.916 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.917 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 14.9 mtt -54.77 -48.16 73.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.189 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -45.35 73.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.413 0.149 . . . . 0.0 110.778 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -61.93 -57.1 13.03 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.7 OUTLIER -58.27 -33.61 69.6 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.692 178.449 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 39' ' ' LEU . . . -70.41 -48.81 54.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.519 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -52.63 64.78 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 121.369 0.604 . . . . 0.0 111.135 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -78.57 -18.02 55.27 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.918 -177.669 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.105 HD21 ' CD2' ' B' ' 120' ' ' TYR . 0.8 OUTLIER -20.95 106.89 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.515 0.726 . . . . 0.0 112.327 -179.732 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.525 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 31.1 mtm-85 95.25 -10.66 0.1 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.636 0.775 . . . . 0.0 112.623 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 38' ' ' ARG . . . -129.07 -174.26 3.21 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.714 0.292 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -144.48 -163.16 1.63 Allowed 'General case' 0 CA--C 1.538 0.498 0 O-C-N 122.367 -0.208 . . . . 0.0 111.406 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.88 43.88 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.848 0.356 . . . . 0.0 111.53 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.0 60.86 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.86 138.43 15.04 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.938 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.567 HG21 HG23 ' A' ' 55' ' ' VAL . 7.2 p -130.91 133.17 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.38 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -103.96 110.42 22.56 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.26 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -171.55 -72.41 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.81 -179.98 5.81 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.004 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -75.18 67.81 1.86 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.137 0.494 . . . . 0.0 111.072 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.12 148.16 20.65 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.598 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 65.7 mtm -81.09 -71.67 0.46 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.3 t -135.5 -27.51 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.912 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.584 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 2.3 pm0 -81.52 131.56 35.28 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.215 0.531 . . . . 0.0 111.87 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.567 HG23 HG21 ' A' ' 46' ' ' VAL . 2.9 p -125.01 82.96 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.441 0.639 . . . . 0.0 110.594 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -109.02 134.89 51.06 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.854 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.571 ' HD2' HG21 ' B' ' 146' ' ' VAL . 0.0 OUTLIER -179.41 148.17 0.34 Allowed 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.494 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.418 ' C ' HG13 ' A' ' 59' ' ' ILE . 0.7 OUTLIER 77.96 134.96 0.06 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.418 HG13 ' C ' ' A' ' 58' ' ' PHE . 1.1 mp -141.63 114.48 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.608 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.17 63.39 0.51 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.153 0.502 . . . . 0.0 111.974 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 41.5 tpp 54.73 71.33 0.54 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.173 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 62.97 -150.37 0.35 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.429 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -112.46 110.73 2.65 Favored Glycine 0 C--N 1.338 0.643 0 C-N-CA 120.68 -0.772 . . . . 0.0 113.395 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -78.18 -52.39 8.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 110.581 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -119.56 171.63 8.23 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.251 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.38 -9.05 21.49 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' A' ' 21' ' ' ASP . 5.7 p-10 -101.74 168.85 9.19 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.444 ' HB3' ' NH1' ' B' ' 143' ' ' ARG . 26.7 tt0 64.6 69.02 0.52 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.947 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.35 72.72 1.41 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.76 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 5.5 tttm -65.24 -21.78 66.79 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -178.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.632 ' HA ' ' CE3' ' B' ' 144' ' ' TRP . 1.6 t70 78.36 -172.84 0.07 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 118.121 0.419 . . . . 0.0 111.159 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.584 ' CE3' ' HA ' ' A' ' 54' ' ' GLU . 27.3 p-90 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.677 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 4.2 mmm . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 120.628 0.252 . . . . 0.0 111.632 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.547 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 18.4 mttm -75.87 -175.24 2.92 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.637 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.585 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 43.5 tp60 -124.45 123.41 40.1 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.653 0.263 . . . . 0.0 110.99 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.575 ' HD3' ' H73' ' C' ' 178' ' ' ' DT' . 5.8 ttm105 -85.92 116.45 24.16 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.354 0.597 . . . . 0.0 111.949 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.739 HD11 HG11 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -114.45 125.78 71.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 177.296 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.835 HG23 ' H73' ' D' ' 191' ' ' ' DT' . 0.2 OUTLIER -131.04 125.72 33.99 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.373 -0.531 . . . . 0.0 112.354 -176.728 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.74 HG22 ' OP1' ' D' ' 190' ' ' ' DG' . 0.9 OUTLIER -102.65 98.46 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 175.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.892 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.5 p -70.27 93.42 0.84 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.523 0.678 . . . . 0.0 110.816 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.098 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.9 t -85.55 -141.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.008 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 26.0 t0 91.01 -9.69 0.28 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 5.2 m -129.03 -56.63 1.18 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.196 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 1.2 m-20 -54.68 -104.19 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -167.14 29.24 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.018 -1.051 . . . . 0.0 111.661 -179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.098 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -72.73 -38.7 67.35 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.647 1.179 . . . . 0.0 112.864 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.642 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.99 -42.27 37.29 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -175.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.626 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -56.37 -34.55 66.76 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.35 0.977 . . . . 0.0 112.857 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.917 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -70.93 -52.36 20.42 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.97 0.414 . . . . 0.0 110.68 179.528 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.86 -25.69 66.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.446 0.641 . . . . 0.0 109.467 177.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -64.08 -33.25 75.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.957 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.105 ' CD2' HD21 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.99 -29.03 21.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.925 -0.56 . . . . 0.0 110.446 179.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.0 t0 123.58 71.26 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.751 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -169.39 -40.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.506 ' O ' ' HE1' ' A' ' 32' ' ' MET . 14.8 m-80 64.47 -106.95 0.16 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.037 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.09 1.12 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 178.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.3 OUTLIER -39.47 -63.76 0.53 Allowed 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.721 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.462 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.38 -29.88 23.57 Favored Glycine 0 CA--C 1.522 0.515 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.945 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.702 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -56.88 -60.53 3.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.453 0.301 . . . . 0.0 110.813 179.187 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.037 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -53.55 -64.86 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.794 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 12.8 p -49.21 -43.96 42.84 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.8 m -72.18 -48.8 40.57 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.23 -36.87 85.07 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.025 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.093 ' HA ' HD12 ' A' ' 17' ' ' LEU . 3.7 mmt -64.42 -54.64 29.56 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.946 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.498 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -48.47 -35.67 13.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.806 -179.595 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -66.35 -57.26 7.83 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.774 ' CB ' HD11 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -73.08 -13.05 61.12 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.478 0.18 . . . . 0.0 111.189 178.626 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.89 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.84 -30.3 20.29 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 121.086 0.47 . . . . 0.0 109.807 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.1 OUTLIER -82.29 -48.26 11.42 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.71 0.767 . . . . 0.0 110.686 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -17.46 61.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 114.028 -1.442 . . . . 0.0 114.095 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.008 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -41.82 149.68 0.13 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.609 0.641 . . . . 0.0 112.521 -178.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER 85.45 73.21 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.081 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -170.07 -149.53 0.07 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.506 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 172.77 13.26 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.954 0.407 . . . . 0.0 111.341 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.444 ' NH1' ' HB3' ' A' ' 68' ' ' GLU . 6.0 mmm180 -79.59 -54.4 5.93 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.618 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.632 ' CE3' ' HA ' ' A' ' 71' ' ' ASP . 3.8 m-90 61.68 -166.56 0.21 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.461 ' CB ' ' O ' ' B' ' 144' ' ' TRP . 1.4 tppt? 89.48 75.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.077 0.551 . . . . 0.0 110.783 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 1.008 HG13 ' HG2' ' B' ' 147' ' ' GLU . 8.7 p -133.08 169.81 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.549 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 1.008 ' HG2' HG13 ' B' ' 146' ' ' VAL . 0.0 OUTLIER 42.33 68.61 0.46 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.219 0.608 . . . . 0.0 112.546 -179.737 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -117.21 50.73 1.07 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.7 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -141.31 160.02 40.99 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.821 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 51.47 48.31 23.18 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.063 0.458 . . . . 0.0 111.269 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -52.37 98.29 0.03 OUTLIER Glycine 0 C--N 1.339 0.701 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.009 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.2 mtt -48.33 151.88 0.98 Allowed 'General case' 0 C--O 1.239 0.513 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.611 HG12 ' CG2' ' B' ' 155' ' ' VAL . 21.6 t -152.94 100.05 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.87 179.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.538 ' HB3' ' HB3' ' B' ' 172' ' ' TRP . 5.6 tp10 -68.08 -55.1 13.75 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.611 ' CG2' HG12 ' B' ' 153' ' ' VAL . 3.5 t 65.17 42.82 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.438 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.4 ' N ' ' CD1' ' B' ' 172' ' ' TRP . . . -53.46 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -177.13 171.86 2.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.849 -0.16 . . . . 0.0 110.876 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -64.72 93.96 0.12 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.802 0.334 . . . . 0.0 110.396 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 12.5 tt -129.73 11.05 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.282 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -126.7 -119.41 0.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.861 -0.154 . . . . 0.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.7 mtm -102.05 -83.55 0.46 Allowed 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.255 -0.278 . . . . 0.0 110.627 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -166.7 93.93 0.49 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 111.278 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -90.23 20.52 36.62 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.549 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 1.1 m -109.03 33.33 4.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.057 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -121.32 -73.69 0.64 Allowed 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 40' ' ' ARG . . . -154.11 -127.57 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.443 0.163 . . . . 0.0 111.155 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -81.99 78.98 8.62 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.094 0.474 . . . . 0.0 111.607 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -165.47 115.93 1.07 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.17 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 177.83 172.71 0.6 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.142 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -159.28 100.36 1.52 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.755 0.312 . . . . 0.0 111.515 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.26 -154.9 0.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.073 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.538 ' HB3' ' HB3' ' B' ' 154' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.508 -0.758 . . . . 0.0 111.472 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.63 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C4'-C3'-C2' 102.597 -0.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.63 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C4'-C3'-C2' 102.759 -0.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.496 ' C5 ' ' C4 ' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 104.54 1.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.635 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.892 0 C4'-C3'-C2' 104.2 1.0 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.62 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.895 0 C4'-C3'-C2' 104.746 1.546 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.735 ' H72' HG21 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 104.591 1.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.732 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.565 0 C3'-C2'-C1' 104.63 1.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.732 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 C4'-C3'-C2' 104.331 1.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.604 ' H8 ' " O5'" ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.515 0 O4'-C1'-C2' 107.188 0.989 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.648 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 105.895 2.282 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.651 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 C3'-C2'-C1' 104.791 1.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.651 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 N19-C1'-C2' 115.209 0.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 O4'-C1'-C2' 106.977 0.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C1'-C2' 107.082 0.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 106.97 0.791 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C4'-C3'-C2' 102.75 -0.45 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.688 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 C4'-C3'-C2' 101.744 -1.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.74 ' OP1' HG22 ' B' ' 107' ' ' VAL . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C4'-C3'-C2' 104.696 1.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.835 ' H73' HG23 ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C4'-C3'-C2' 104.543 1.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.433 " H2'" ' H71' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.934 0 C1'-O4'-C4' 107.477 -1.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.433 ' H71' " H2'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.735 0 C4'-C3'-C2' 105.039 1.839 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.649 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 C3'-C2'-C1' 104.144 1.032 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.649 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.9 0 C4'-C3'-C2' 104.636 1.436 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.456 ' H8 ' H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.594 0 C3'-C2'-C1' 104.42 1.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.445 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 N19-C1'-C2' 115.376 0.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.437 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 O4'-C4'-C3' 106.15 0.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.655 0.264 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -92.11 -171.24 2.77 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 179.471 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' B' ' 108' ' ' THR . 60.8 tp60 -108.79 111.15 22.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.311 0.577 . . . . 0.0 112.095 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.0 ttm-85 -79.36 103.6 9.4 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.64 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.811 HG12 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -98.1 130.34 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.066 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.076 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.794 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -131.32 130.07 42.27 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 117.799 -1.561 . . . . 0.0 114.191 -177.745 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 1.044 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -100.63 108.05 22.34 Favored 'Isoleucine or valine' 0 C--N 1.34 0.191 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.076 177.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.16 87.5 0.79 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.806 0.813 . . . . 0.0 109.477 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.074 HG21 ' CD2' ' A' ' 14' ' ' TYR . 4.7 m -71.43 -155.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.271 -178.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.668 ' CB ' ' HA ' ' B' ' 102' ' ' LYS . 22.3 t70 91.24 -19.04 0.14 Allowed 'General case' 0 C--N 1.35 0.626 0 C-N-CA 123.689 0.795 . . . . 0.0 109.783 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.3 m -110.26 -69.6 0.86 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.852 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.647 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -51.69 -88.71 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.579 ' O ' ' HB2' ' B' ' 132' ' ' MET . 1.3 m 175.29 46.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.323 0.965 . . . . 0.0 111.874 -178.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.074 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.44 -44.72 15.69 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -179.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 61.5 mt-30 -47.99 -38.43 16.96 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -175.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.876 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.0 OUTLIER -61.38 -57.38 12.51 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.746 0.703 . . . . 0.0 112.669 -179.718 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.79 ' CB ' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -47.31 -48.84 25.04 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.431 0.634 . . . . 0.0 112.128 -178.053 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.621 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 2.9 pttt -78.98 -29.39 43.79 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.262 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -64.94 -27.46 68.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.715 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.135 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.33 -43.06 11.8 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 118.667 -0.683 . . . . 0.0 110.445 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.5 t70 168.98 15.3 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 178.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.55 HG11 HD13 ' A' ' 27' ' ' LEU . 65.7 t -142.4 84.75 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -177.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.01 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -71.77 51.47 0.2 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.206 0.526 . . . . 0.0 110.852 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.143 HD11 HD12 ' B' ' 105' ' ' ILE . 0.9 OUTLIER 40.9 -8.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 118.97 2.952 . . . . 0.0 118.97 179.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.545 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 0.2 OUTLIER -38.52 -63.24 0.52 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-N 119.99 1.268 . . . . 0.0 110.439 -179.022 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.1 -28.44 34.08 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.549 178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.64 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 11.3 tp -63.3 -62.19 1.85 Allowed 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.717 0.259 . . . . 0.0 110.692 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.005 HG22 HG22 ' B' ' 128' ' ' VAL . 2.3 t -45.65 -64.61 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 O-C-N 123.373 0.421 . . . . 0.0 110.426 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.648 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 4.8 p -49.18 -35.26 16.51 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 123.136 0.273 . . . . 0.0 111.57 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 19.4 m -69.95 -52.15 26.82 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.503 ' CG2' HD11 ' B' ' 127' ' ' LEU . 86.0 m -55.89 -39.02 70.95 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.293 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.909 ' CE ' HG21 ' B' ' 124' ' ' ILE . 0.3 OUTLIER -54.84 -55.51 29.54 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.695 179.198 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -44.87 87.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.103 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.1 -50.82 62.75 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.184 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.763 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.64 -33.88 76.91 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.137 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.703 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -61.28 -45.09 95.93 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.77 -51.94 55.03 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.839 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -63.72 -35.27 80.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.055 -1.429 . . . . 0.0 113.531 -177.587 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.731 HD12 ' CD1' ' B' ' 120' ' ' TYR . 0.1 OUTLIER -25.04 -56.65 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.73 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.596 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -90.22 57.85 3.87 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.517 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' A' ' 40' ' ' ARG . . . 151.18 98.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.456 0.702 . . . . 0.0 110.935 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.459 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -86.75 -143.17 0.11 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.239 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.99 -133.9 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 122.15 -0.343 . . . . 0.0 110.83 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.495 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 3.4 m95 -127.3 143.69 51.18 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.881 0.372 . . . . 0.0 110.884 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -106.13 133.34 50.99 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.386 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.0 t 75.97 154.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.025 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.88 35.1 11.19 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.071 0.462 . . . . 0.0 111.357 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 22.2 p-10 -166.35 104.85 0.63 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.193 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -155.03 -168.66 2.95 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.082 0.468 . . . . 0.0 112.119 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.502 ' O ' ' NH1' ' B' ' 138' ' ' ARG . 25.9 mt-10 66.94 -93.28 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.689 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.44 132.3 0.2 Allowed Glycine 0 CA--C 1.524 0.594 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.528 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.95 169.61 17.31 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.945 0.402 . . . . 0.0 111.743 -179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.12 -64.36 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.457 ' HA ' ' HB3' ' A' ' 72' ' ' TRP . 2.3 mp0 33.18 55.67 0.47 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.354 0.597 . . . . 0.0 112.029 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.402 HG23 ' NE1' ' A' ' 72' ' ' TRP . 3.9 m -79.49 62.6 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.795 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -86.78 -31.77 20.73 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.177 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -112.34 121.03 43.72 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.299 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.93 -53.96 22.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.48 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.1 mt 66.8 -60.37 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.461 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -120.48 118.42 30.22 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.974 0.416 . . . . 0.0 110.734 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 ptt? -70.92 58.4 0.21 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.091 0.472 . . . . 0.0 111.818 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -106.32 6.99 31.07 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.691 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 59.59 -99.1 0.14 Allowed Glycine 0 C--N 1.338 0.657 0 C-N-CA 121.193 -0.527 . . . . 0.0 113.049 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 41.13 59.96 2.16 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.984 0.421 . . . . 0.0 111.819 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -148.44 142.29 25.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.274 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.38 -83.69 0.39 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.111 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -162.53 129.05 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.36 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 67' ' ' ASP . 39.7 tp10 173.56 -72.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.877 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p30 42.17 57.86 3.15 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.423 ' NZ ' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -167.86 147.76 4.97 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 179.212 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.13 69.21 0.74 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.98 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.457 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 5.2 m95 . . . . . 0 C--O 1.252 1.198 0 CA-C-O 118.613 -0.708 . . . . 0.0 110.741 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 120.437 0.161 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.668 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 10.0 mmtt -58.89 153.88 16.34 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.267 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.871 ' O ' HG22 ' A' ' 9' ' ' VAL . 16.6 tp60 -121.19 125.8 48.08 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 121.66 0.743 . . . . 0.0 111.609 179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.502 ' NE ' ' H73' ' C' ' 178' ' ' ' DT' . 1.7 ttm180 -83.81 116.62 22.81 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.317 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.143 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -94.53 123.48 46.66 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.313 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.659 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -131.07 111.93 12.44 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.269 -0.973 . . . . 0.0 111.482 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.811 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -101.56 98.25 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 175.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.976 HG22 ' HG3' ' A' ' 4' ' ' ARG . 72.1 p -68.25 93.44 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.842 -178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.067 HG21 ' CB ' ' B' ' 114' ' ' TYR . 6.3 t -80.57 -125.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.143 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.688 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.6 t70 83.21 -15.22 0.66 Allowed 'General case' 0 C--N 1.349 0.557 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -176.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.11 -59.25 1.42 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.997 177.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.66 ' HB2' HG13 ' B' ' 109' ' ' VAL . 1.2 m-20 -46.24 -98.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' MET . 24.9 t -175.6 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.461 -0.774 . . . . 0.0 110.504 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.067 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -81.63 -46.58 14.17 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.014 0.926 . . . . 0.0 113.406 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.94 -40.78 31.54 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.797 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.703 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -53.66 -25.35 17.66 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.661 0.664 . . . . 0.0 112.385 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.11 -60.43 2.37 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.711 0.767 . . . . 0.0 110.269 178.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.7 pttt -62.4 -25.11 67.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.19 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.64 -23.93 19.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.18 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.731 ' CD1' HD12 ' A' ' 39' ' ' LEU . 65.9 m-85 -87.52 -50.98 6.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 24.0 t0 136.83 54.52 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 O-C-N 124.726 1.266 . . . . 0.0 109.913 179.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.625 ' CG1' HD13 ' B' ' 117' ' ' LEU . 7.1 p -154.1 87.1 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.095 -178.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.948 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -70.55 52.9 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.948 HD12 ' O ' ' B' ' 123' ' ' ASN . 1.3 pp 29.08 10.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 119.433 3.123 . . . . 0.0 119.433 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 1.044 ' HA ' HG22 ' A' ' 7' ' ' VAL . 3.2 p -37.24 -60.91 0.62 Allowed 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 122.765 0.426 . . . . 0.0 110.891 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.725 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.95 -19.55 61.05 Favored Glycine 0 C--O 1.222 -0.644 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.279 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.725 HD12 ' CG2' ' B' ' 124' ' ' ILE . 2.7 tm? -67.36 -56.44 9.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 117.151 0.476 . . . . 0.0 110.745 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.005 HG22 HG22 ' A' ' 28' ' ' VAL . 95.5 t -59.06 -68.65 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 120.951 0.405 . . . . 0.0 110.157 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.647 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 56.3 p -50.32 -38.24 40.66 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.725 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -82.57 -50.02 9.25 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.177 1.353 . . . . 0.0 111.413 -179.286 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -51.43 -31.44 22.97 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.973 -179.394 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.79 ' SD ' ' CB ' ' A' ' 17' ' ' LEU . 2.1 mmt -61.3 -50.57 72.44 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.227 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.573 ' CB ' ' CB ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -49.94 -40.32 43.24 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.518 0.599 . . . . 0.0 111.171 179.4 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -68.18 -49.41 61.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.773 ' HB2' HD21 ' A' ' 17' ' ' LEU . 4.3 mm-40 -77.28 -18.94 57.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.862 0.363 . . . . 0.0 110.532 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.876 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -75.21 -34.97 61.53 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 177.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -56.14 4.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 121.785 0.802 . . . . 0.0 109.516 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.502 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -64.1 -17.65 63.64 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 114.016 -1.447 . . . . 0.0 114.781 -177.506 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.135 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -44.48 -26.85 0.39 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -178.435 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.846 ' HD2' HD13 ' B' ' 139' ' ' LEU . 1.4 mpt_? -129.82 153.85 47.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.025 0.44 . . . . 0.0 111.298 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -80.31 111.57 16.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.269 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.13 79.12 1.65 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.356 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 9.5 ttm180 -175.93 141.33 0.46 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.526 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.552 ' O ' ' HB3' ' B' ' 145' ' ' LYS . 2.0 t90 -101.37 134.79 43.91 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.151 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.552 ' HB3' ' O ' ' B' ' 144' ' ' TRP . 1.9 tmpt? 74.99 136.57 0.06 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.336 0.397 . . . . 0.0 110.264 -178.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 10.9 m -132.45 128.21 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.6 -168.39 1.95 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.648 179.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -145.72 133.85 21.56 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 111.98 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -150.76 110.96 4.15 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.659 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -154.15 166.66 32.38 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.959 0.409 . . . . 0.0 111.389 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 130.61 -84.02 0.31 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.266 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 61.66 -161.1 0.3 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.748 0.308 . . . . 0.0 111.523 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 2.8 t 61.85 57.34 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.206 0.526 . . . . 0.0 111.316 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -51.32 70.0 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.521 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.496 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 8.8 t 67.71 53.85 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-O 121.446 0.641 . . . . 0.0 111.865 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.415 ' N ' ' CD1' ' B' ' 172' ' ' TRP . . . -72.58 173.89 8.29 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 32.3 mmt-85 -93.7 -45.87 7.5 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.192 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 68.81 176.85 0.27 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.995 0.426 . . . . 0.0 111.894 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -144.37 -56.29 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.561 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.71 147.1 29.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.68 -84.85 0.39 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.155 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.89 -163.22 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.557 0.218 . . . . 0.0 111.337 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 146.66 -173.16 26.99 Favored Glycine 0 C--N 1.337 0.617 0 C-N-CA 120.474 -0.87 . . . . 0.0 114.025 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 1.3 m -103.33 -95.82 0.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.204 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -151.91 67.58 0.87 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.025 0.441 . . . . 0.0 111.704 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . 59.95 17.09 6.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 111.575 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.03 -96.42 0.47 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.363 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.54 86.88 0.2 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.187 0.518 . . . . 0.0 110.254 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -167.74 161.59 13.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.413 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.509 ' O ' ' HE3' ' B' ' 170' ' ' LYS . 0.1 OUTLIER 79.85 83.58 0.05 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.691 179.327 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -141.4 -168.33 2.61 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.57 179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.496 ' CE2' ' HA ' ' B' ' 155' ' ' VAL . 1.9 m-90 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.724 -0.655 . . . . 0.0 111.86 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.449 H2'' " H5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.755 0 C3'-C2'-C1' 105.939 2.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.688 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 C4'-C3'-C2' 101.763 -1.437 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.688 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.508 0 C3'-C2'-C1' 104.714 1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.471 ' H72' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.865 0 O4'-C1'-C2' 104.847 -1.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.552 ' OP1' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.425 -0.95 0 C4'-C3'-C2' 104.624 1.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.656 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.992 0 C1'-O4'-C4' 107.294 -1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.651 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.552 0 C3'-C2'-C1' 104.663 1.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.651 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 103.966 0.766 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.443 ' H8 ' " O5'" ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 C3'-C2'-C1' 104.072 0.98 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.657 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.764 0 C3'-C2'-C1' 105.485 1.989 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.657 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 O4'-C1'-C2' 107.14 0.945 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.63 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 101.491 -0.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . 0.442 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 110.271 0.408 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.715 0.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.439 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 N19-C1'-C2' 113.242 -0.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.546 H2'' ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 C3'-C2'-C1' 104.256 1.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.546 ' C8 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C4'-C3'-C2' 104.215 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.625 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C3'-C2'-C1' 105.383 1.916 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.625 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 O4'-C4'-C3' 104.229 -1.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.558 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.685 0 C3'-C2'-C1' 104.121 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.433 ' H71' " H2'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 C4'-C3'-C2' 104.973 1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.683 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C3'-C2'-C1' 104.214 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.683 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C1'-O4'-C4' 107.348 -1.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.491 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.246 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.491 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 N19-C1'-C2' 115.362 0.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.404 ' C2 ' ' N1 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C4'-C3'-C2' 103.73 0.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ttp . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.385 0.136 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.514 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 5.2 mtmt -116.96 152.9 33.58 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.742 0.306 . . . . 0.0 110.581 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.682 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 20.1 tp60 -118.46 113.78 21.87 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.029 0.442 . . . . 0.0 111.08 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.797 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.5 OUTLIER -79.96 107.98 13.17 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.746 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.992 HD13 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -112.78 128.05 69.69 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.779 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -127.87 136.26 51.16 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.53 -177.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 1.063 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.65 106.89 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.326 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 3.2 p -70.37 91.74 0.77 Allowed 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.721 -0.392 . . . . 0.0 109.957 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.979 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.3 t -85.39 -139.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.112 -178.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.549 ' H ' HG12 ' A' ' 9' ' ' VAL . 24.8 t0 92.32 -10.4 0.2 Allowed 'General case' 0 C--N 1.35 0.606 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -175.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 m -129.67 -54.06 1.15 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.06 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.82 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -48.1 -99.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.505 ' N ' ' HB2' ' B' ' 129' ' ' SER . 0.2 OUTLIER -176.28 37.64 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.32 -0.863 . . . . 0.0 110.734 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.979 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.75 -35.27 26.76 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.368 1.067 . . . . 0.0 113.786 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.518 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.95 -46.25 43.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.679 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -50.64 -33.32 21.9 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.9 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 2.2 mt -74.52 -60.07 2.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.361 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.98 -26.29 68.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.716 0.77 . . . . 0.0 109.815 178.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.04 -31.61 72.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.883 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.014 ' CE2' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.24 -38.73 15.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.331 179.491 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.684 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 29.8 t70 146.83 31.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.552 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 54.6 t -161.61 99.85 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 O-C-N 122.254 -0.279 . . . . 0.0 111.071 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.523 ' O ' ' HE1' ' B' ' 132' ' ' MET . 42.3 m-80 -54.3 -88.34 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 177.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.896 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -161.4 7.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 24' ' ' ILE . 1.5 p -38.72 -62.74 0.58 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.551 0.614 . . . . 0.0 110.748 -177.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.4 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -84.18 -30.52 28.0 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.722 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.896 ' HB3' HG22 ' A' ' 24' ' ' ILE . 1.1 tm? -59.8 -59.91 4.68 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.782 0.291 . . . . 0.0 110.769 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.884 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -49.71 -65.4 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.418 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.902 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.799 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -49.22 -41.06 36.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.3 m -67.69 -54.08 22.43 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -40.01 94.16 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.088 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.812 ' SD ' ' CB ' ' B' ' 117' ' ' LEU . 3.5 mmt -57.97 -58.05 10.1 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.677 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.637 ' HB2' ' HB3' ' B' ' 113' ' ' SER . 0.1 OUTLIER -51.86 -37.91 53.97 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.118 0.417 . . . . 0.0 111.398 179.804 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.04 -55.38 7.48 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.813 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -21.47 64.8 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.047 0.451 . . . . 0.0 109.81 178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -73.44 -49.18 28.26 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -51.12 69.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.769 0.795 . . . . 0.0 109.324 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.82 -49.02 74.49 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 114.138 -1.392 . . . . 0.0 111.173 -178.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.765 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 20.08 77.72 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.866 0.866 . . . . 0.0 112.629 179.636 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.92 -53.68 0.81 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.212 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -155.54 -105.34 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 67.23 142.62 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.235 0.541 . . . . 0.0 111.667 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.33 179.52 7.87 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.95 -178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.44 -170.6 1.82 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.278 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.94 -67.39 0.22 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -133.2 123.57 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.856 0.36 . . . . 0.0 111.609 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.669 ' HB3' HG13 ' B' ' 153' ' ' VAL . 0.0 OUTLIER -47.94 -65.68 0.53 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.674 179.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.76 43.3 25.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.956 0.408 . . . . 0.0 111.219 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.92 78.37 3.49 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.83 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -109.72 118.56 36.86 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.069 0.461 . . . . 0.0 111.249 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -155.27 -167.39 16.83 Favored Glycine 0 C--N 1.332 0.312 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.65 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.6 mmm 61.22 21.5 11.95 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 p -162.17 123.52 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.984 0.421 . . . . 0.0 111.203 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -161.09 158.12 27.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.834 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -145.48 62.87 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.971 0.415 . . . . 0.0 111.715 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.04 77.42 0.23 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.819 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.469 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -151.95 158.83 43.67 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.377 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 1.4 m-85 74.78 154.7 0.16 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.011 0.434 . . . . 0.0 111.513 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.6 mt -123.28 104.69 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.821 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.17 78.66 1.61 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.634 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 10.1 mmt -152.78 125.86 8.54 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.277 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.37 53.15 0.89 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.392 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -177.07 -64.46 0.06 OUTLIER Glycine 0 CA--C 1.524 0.615 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.836 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.91 -84.63 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 122.366 0.267 . . . . 0.0 110.65 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 55.51 24.38 6.8 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -154.77 28.68 0.43 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.659 0.266 . . . . 0.0 111.672 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 67.87 148.78 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.242 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.406 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 60.95 -173.7 0.13 Allowed 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.355 0.598 . . . . 0.0 112.016 -179.681 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -146.35 60.82 1.23 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.042 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 10.9 mmtp -133.84 154.8 50.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.0 0.429 . . . . 0.0 111.721 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -179.46 159.58 0.92 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.961 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.417 ' CE2' ' HB2' ' A' ' 54' ' ' GLU . 25.9 p-90 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.001 -1.0 . . . . 0.0 111.216 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 120.275 0.083 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 9.3 mmtm 71.21 113.85 0.05 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.594 0.559 . . . . 0.0 110.518 -179.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.717 ' OE1' HG22 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -95.98 114.88 26.64 Favored 'General case' 0 CA--C 1.495 -1.157 0 CA-C-O 121.094 0.473 . . . . 0.0 111.979 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.7 ' CZ ' HG21 ' A' ' 6' ' ' THR . 7.4 ttt-85 -79.31 98.97 6.89 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.658 -0.817 . . . . 0.0 108.998 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.717 HG22 ' OE1' ' B' ' 103' ' ' GLN . 0.3 OUTLIER -99.02 110.69 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 178.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.779 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -116.25 120.4 38.84 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.127 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.992 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.19 109.56 25.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 174.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.797 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.1 p -70.28 80.38 0.53 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.932 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.4 p -87.97 -140.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.358 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.702 ' H ' HG22 ' B' ' 109' ' ' VAL . 3.3 t70 86.44 -3.9 0.72 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 122.103 0.954 . . . . 0.0 108.854 -175.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -124.32 -64.91 1.09 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.152 177.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.799 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -44.48 -85.85 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.038 -179.212 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.637 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 2.2 m 176.38 39.51 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 119.011 0.823 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.932 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.58 -43.22 15.91 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.621 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.8 OUTLIER -47.65 -39.26 16.65 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -174.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.811 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.7 -56.04 26.78 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.444 1.02 . . . . 0.0 111.734 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.812 ' CB ' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -52.11 -43.56 64.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.998 -178.326 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.621 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -79.26 -31.97 43.6 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.492 179.007 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -57.3 -30.21 64.55 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.493 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.765 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.45 -46.26 9.28 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 118.366 -0.826 . . . . 0.0 109.731 178.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.657 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 155.95 32.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.542 HG12 ' O ' ' B' ' 122' ' ' VAL . 46.4 t -145.88 84.53 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.041 ' O ' HD12 ' B' ' 124' ' ' ILE . 53.4 m-80 -68.95 61.22 0.1 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.076 0.465 . . . . 0.0 110.887 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.063 HD13 HG12 ' A' ' 7' ' ' VAL . 0.7 OUTLIER 42.57 -6.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -179.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.486 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.88 -62.86 0.58 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.789 1.177 . . . . 0.0 110.274 -179.008 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.05 -29.7 24.96 Favored Glycine 0 C--N 1.34 0.783 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.482 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.723 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -59.22 -61.16 2.84 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.827 0.451 . . . . 0.0 110.233 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.979 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -49.64 -59.23 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.563 179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.0 p -50.0 -39.77 42.36 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 52.2 m -70.14 -50.35 41.36 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 6.8 m -61.63 -43.73 98.31 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.086 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.9 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 7.0 mtt -59.54 -57.5 12.68 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.104 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -42.86 71.31 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.163 0.289 . . . . 0.0 111.393 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -66.76 -53.08 36.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.561 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.55 ' O ' HD12 ' B' ' 139' ' ' LEU . 5.7 tp10 -64.07 -32.67 74.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.679 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -68.05 -50.9 52.41 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.272 0.629 . . . . 0.0 111.18 178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -52.39 63.83 Favored 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -53.0 -44.95 67.64 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.904 -1.498 . . . . 0.0 110.458 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.014 HD11 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -36.09 -51.71 0.75 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.515 0.726 . . . . 0.0 112.35 179.268 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.45 111.76 24.59 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.004 0.43 . . . . 0.0 111.847 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.72 112.66 2.35 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.002 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -153.77 151.23 29.34 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.084 0.469 . . . . 0.0 111.282 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -106.68 -29.75 9.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.302 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -51.18 107.93 0.21 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.029 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.414 ' NZ ' ' OE2' ' B' ' 147' ' ' GLU . 0.0 OUTLIER -152.75 131.24 12.18 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.883 0.373 . . . . 0.0 111.688 -179.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' B' ' 147' ' ' GLU . 7.5 p -96.46 21.58 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.716 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' B' ' 146' ' ' VAL . 0.5 OUTLIER 68.93 -62.67 0.39 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -151.35 169.23 22.48 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.006 0.432 . . . . 0.0 111.986 -179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -119.34 -79.0 0.59 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.783 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.09 -73.05 0.31 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.852 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . 0.529 ' HA2' ' HG2' ' A' ' 47' ' ' GLU . . . 110.21 47.86 0.79 Allowed Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.045 -0.598 . . . . 0.0 113.01 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.0 63.54 1.33 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.853 0.327 . . . . 0.0 111.796 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.669 HG13 ' HB3' ' A' ' 47' ' ' GLU . 27.0 m -60.02 -33.64 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.46 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.57 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . 0.0 OUTLIER -98.65 154.67 17.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.881 0.372 . . . . 0.0 110.804 179.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.05 52.96 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.215 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -101.96 119.44 38.8 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.292 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 4.9 ptt85 -71.43 66.03 0.46 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.156 0.503 . . . . 0.0 111.254 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -82.28 175.29 10.39 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.301 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 9.1 tp -128.7 144.36 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.174 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 73.97 168.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.359 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -149.69 26.91 0.82 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -84.08 96.36 8.88 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.29 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -96.23 -85.18 1.73 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.442 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 38.3 t 51.02 38.78 21.47 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -95.29 -68.49 0.8 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.85 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -155.7 -122.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.54 66.64 5.07 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.066 0.46 . . . . 0.0 111.545 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 59.97 -167.49 0.17 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.1 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -150.22 152.53 34.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.249 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.16 137.09 42.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.938 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.67 -179.8 4.98 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.734 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.57 ' HB2' ' HB2' ' B' ' 154' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.08 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.089 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C1'-O4'-C4' 110.233 0.38 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.751 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C1'-C2' 106.779 0.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.751 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 104.535 1.311 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.504 ' H71' " H2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.653 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.047 0 C4'-C3'-C2' 104.697 1.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.653 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.534 0.649 0 C4'-C3'-C2' 104.154 0.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.583 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.765 0 C3'-C2'-C1' 105.853 2.252 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.923 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C3'-C2'-C1' 101.306 -0.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.923 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 O4'-C1'-C2' 107.159 0.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.626 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.761 0 C3'-C2'-C1' 105.494 1.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.678 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 O4'-C1'-C2' 106.938 0.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.678 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C3'-C2'-C1' 101.94 -0.543 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.267 1.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.556 " H5'" ' C5 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 N19-C1'-C2' 115.573 0.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.556 ' C5 ' " H5'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.591 -0.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.936 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C1'-O4'-C4' 110.4 0.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.936 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.509 0 O4'-C1'-C2' 107.128 0.935 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.54 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.877 0 C1'-O4'-C4' 106.406 -2.353 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.663 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C3'-C2'-C1' 104.829 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.567 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C3'-C2'-C1' 105.01 1.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.678 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.412 -0.619 0 C3'-C2'-C1' 105.182 1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.521 " O5'" H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O4'-C1'-C2' 107.462 1.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.467 H2'' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.664 -1.454 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.719 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 C3'-C2'-C1' 104.753 1.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.719 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.289 0.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 C3'-C2'-C1' 101.954 -0.533 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 120.072 -0.013 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.96 161.32 2.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.267 0.354 . . . . 0.0 111.218 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.539 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 44.2 tp60 -123.67 118.44 27.26 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.372 0.606 . . . . 0.0 112.057 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.04 115.28 18.61 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.308 179.191 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.718 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -110.18 123.24 65.91 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.31 126.03 34.29 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.605 -0.838 . . . . 0.0 112.579 -177.017 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.799 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -102.13 107.15 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.651 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 3.5 p -70.86 89.38 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.143 0.497 . . . . 0.0 110.864 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.182 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.9 m -83.25 -150.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.808 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.569 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 25.5 t0 94.82 -7.87 0.11 Allowed 'General case' 0 C--N 1.348 0.519 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -127.98 -59.6 1.18 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.466 -1.243 . . . . 0.0 108.854 176.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.16 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.44 ' CB ' ' HZ3' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -175.41 38.35 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.288 0.949 . . . . 0.0 111.107 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.182 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.98 -44.88 16.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.171 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.581 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 13.1 mt-30 -49.24 -43.72 42.97 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.658 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -53.25 -30.97 41.19 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 118.589 0.632 . . . . 0.0 112.132 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.966 ' CD1' HD22 ' A' ' 27' ' ' LEU . 1.7 mt -77.78 -51.77 9.99 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.988 0.423 . . . . 0.0 111.69 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.668 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -65.79 -25.35 67.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.411 0.624 . . . . 0.0 110.199 178.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.55 -31.02 55.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.747 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.57 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 46.1 m-85 -88.63 -39.82 13.78 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.22 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.2 t70 118.33 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.474 1.13 . . . . 0.0 110.149 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.546 ' HB ' HD22 ' A' ' 17' ' ' LEU . 64.6 t -130.59 -47.5 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.156 0 CA-C-N 113.979 -1.464 . . . . 0.0 109.46 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.598 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.8 m120 58.3 -113.86 0.73 Allowed 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.111 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.959 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.0 -0.45 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 115.872 1.805 . . . . 0.0 115.872 -179.556 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.539 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 9.2 t -39.78 -64.44 0.49 Allowed 'General case' 0 C--O 1.24 0.59 0 C-N-CA 119.575 -0.85 . . . . 0.0 109.968 -178.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.534 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -81.45 -27.06 49.39 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.245 178.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.966 HD22 ' CD1' ' A' ' 17' ' ' LEU . 5.3 tp -62.5 -61.52 2.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.768 0.284 . . . . 0.0 111.008 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.823 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.7 t -51.83 -70.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.755 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 38.5 p -47.68 -42.53 25.02 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.534 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -74.57 -45.64 44.08 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 119.032 0.833 . . . . 0.0 109.778 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.571 HG23 HD11 ' B' ' 127' ' ' LEU . 0.5 OUTLIER -68.47 -27.92 66.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.568 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.887 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.5 mmt -57.08 -55.63 32.22 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.368 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.47 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.63 -53.34 53.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.03 0.443 . . . . 0.0 110.42 179.689 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.47 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 1.9 m-20 -57.28 -50.83 71.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.049 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.641 ' HG3' HD21 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -68.43 -30.27 69.11 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.13 0.491 . . . . 0.0 109.874 177.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.73 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -67.04 -43.26 83.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.065 0.459 . . . . 0.0 110.374 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -78.91 -54.67 5.82 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.273 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.452 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 9.2 tpp180 -79.31 -31.24 43.17 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 114.662 -1.154 . . . . 0.0 114.039 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.635 ' CD1' ' HB2' ' B' ' 167' ' ' ASP . 0.1 OUTLIER 26.2 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.691 0.758 . . . . 0.0 112.704 -178.289 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.591 ' HB2' ' HG3' ' A' ' 42' ' ' GLU . 8.6 mmm180 -113.01 -18.5 12.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.009 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 58.73 33.31 22.98 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.189 0.519 . . . . 0.0 110.544 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.605 ' HB3' ' CD1' ' A' ' 44' ' ' TRP . 10.4 mt-10 -73.93 72.34 1.6 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.866 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.515 ' HA ' HG21 ' B' ' 130' ' ' THR . 2.4 ptp85 -70.72 64.8 0.31 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.358 0.599 . . . . 0.0 110.208 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.677 ' HA ' ' HG2' ' B' ' 149' ' ' GLN . 10.3 m95 -68.64 64.38 0.11 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.342 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -170.69 154.87 4.6 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.162 0.506 . . . . 0.0 112.165 179.257 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.573 ' N ' ' HD2' ' A' ' 45' ' ' LYS . 5.9 p -162.61 -51.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.058 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' N ' HG13 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -172.25 152.07 2.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.141 179.441 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -145.25 86.74 1.78 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 111.929 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -113.07 -34.79 5.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.494 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -68.51 97.88 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.034 0.445 . . . . 0.0 111.058 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.76 -166.31 20.38 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.124 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.16 95.91 0.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.789 0.328 . . . . 0.0 111.265 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.06 129.36 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.585 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.618 ' O ' HG13 ' A' ' 55' ' ' VAL . 46.0 mm-40 -106.48 -169.44 1.56 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.218 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.799 ' HA ' ' CD1' ' A' ' 72' ' ' TRP . 0.1 OUTLIER -164.44 35.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-O 121.107 0.48 . . . . 0.0 111.315 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.73 64.7 0.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.109 0.48 . . . . 0.0 111.441 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.5 38.1 4.18 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.436 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.21 158.39 17.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.048 0.451 . . . . 0.0 111.484 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.9 mm -71.27 73.49 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.034 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -120.92 132.05 54.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.908 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.35 -38.11 74.75 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.742 0.306 . . . . 0.0 110.764 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.86 77.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.261 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -64.77 112.27 4.87 Favored Glycine 0 C--N 1.334 0.467 0 CA-C-N 115.892 -0.595 . . . . 0.0 113.77 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 86.0 p -77.4 76.5 3.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.759 0.314 . . . . 0.0 110.735 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -108.29 -56.18 2.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.273 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.65 -124.6 0.17 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.455 ' OD2' HD13 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -111.31 -60.0 1.9 Allowed 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.291 -0.255 . . . . 0.0 111.395 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -126.71 -68.19 0.82 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.572 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -66.52 -172.1 0.15 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.387 0.613 . . . . 0.0 112.473 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.98 145.99 44.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.034 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.445 ' HB3' ' HG3' ' A' ' 54' ' ' GLU . 1.5 t70 -101.46 -176.28 3.1 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.884 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.799 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 63.8 t-105 . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.416 0.447 . . . . 0.0 111.015 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.503 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 66.03 156.29 0.1 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.843 0.354 . . . . 0.0 111.064 -179.777 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.536 ' HB3' HG23 ' A' ' 9' ' ' VAL . 7.8 tt0 -107.03 109.17 20.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.348 0.594 . . . . 0.0 111.45 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.527 ' NE ' ' H73' ' C' ' 178' ' ' ' DT' . 5.7 ttm180 -78.54 104.82 9.39 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.787 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.86 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.3 pt -104.94 126.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.705 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -130.58 124.54 32.01 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 119.618 -0.833 . . . . 0.0 112.859 -177.608 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.884 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.94 103.95 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 173.973 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.839 HG22 ' HG3' ' A' ' 4' ' ' ARG . 15.9 p -66.24 93.06 0.2 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.921 0.391 . . . . 0.0 110.673 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.936 HG21 ' HB2' ' B' ' 114' ' ' TYR . 1.4 t -96.49 -135.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.596 -178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.539 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 5.4 t70 101.06 12.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 122.623 1.201 . . . . 0.0 108.615 -175.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.569 ' H ' HG12 ' B' ' 109' ' ' VAL . 44.8 m -159.65 -48.23 0.05 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.065 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.755 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -69.59 50.62 0.1 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 32' ' ' MET . 0.1 OUTLIER 57.9 3.05 0.2 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 177.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.936 ' HB2' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -59.08 -56.48 21.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 118.377 0.535 . . . . 0.0 111.817 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.567 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 28.6 mt-30 -48.84 -35.95 15.79 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.73 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -53.69 -43.88 69.28 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.418 0.554 . . . . 0.0 111.218 179.61 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.887 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.3 mt -65.47 -55.38 18.27 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.681 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -66.8 -25.49 66.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.96 179.778 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.476 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.36 -25.28 23.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.919 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.713 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.3 m-30 -88.12 -51.24 5.9 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.9 OUTLIER 132.53 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 O-C-N 125.069 1.481 . . . . 0.0 110.996 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.85 ' CG1' HD22 ' B' ' 117' ' ' LEU . 7.8 p -142.72 -39.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.658 ' O ' HD13 ' B' ' 117' ' ' LEU . 28.9 m-80 61.63 -120.96 0.75 Allowed 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.065 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -142.48 6.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.406 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -39.77 -63.92 0.54 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.13 0.491 . . . . 0.0 110.369 -178.253 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.55 -27.66 26.61 Favored Glycine 0 C--N 1.335 0.513 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.167 178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -61.99 -62.22 1.94 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 122.44 0.296 . . . . 0.0 110.789 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.065 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -50.29 -59.27 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.863 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.783 178.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.716 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.5 p -50.39 -38.0 40.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.515 HG21 ' HA ' ' A' ' 43' ' ' ARG . 99.5 m -72.23 -55.6 6.95 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.464 HG22 HD21 ' A' ' 27' ' ' LEU . 54.5 m -56.52 -40.28 74.77 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.261 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.947 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.5 OUTLIER -54.17 -56.12 21.27 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.731 179.452 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.467 ' OE1' ' HD3' ' A' ' 45' ' ' LYS . 12.6 tt0 -58.33 -37.68 75.61 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.07 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.468 ' O ' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -66.02 -29.01 69.29 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.883 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.658 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -65.35 -47.75 75.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.95 0.405 . . . . 0.0 110.273 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HD3' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -72.76 -50.98 21.01 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.738 0.78 . . . . 0.0 110.386 178.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.635 ' HG3' ' HA ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -71.0 -17.21 62.65 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.078 -1.419 . . . . 0.0 113.78 -177.167 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.533 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -24.63 113.1 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.594 0.358 . . . . 0.0 111.451 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.439 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 0.8 OUTLIER 88.18 94.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.156 -178.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 69.93 129.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.158 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.635 ' HA ' ' HG3' ' B' ' 138' ' ' ARG . 1.6 mp0 -81.07 137.49 36.01 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.098 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.4 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.1 ttm180 172.83 -164.29 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.298 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 82.2 131.92 0.05 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.161 0.584 . . . . 0.0 112.066 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.58 139.25 38.41 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.926 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.453 ' O ' HG13 ' B' ' 146' ' ' VAL . 12.4 p 177.29 48.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.525 0.679 . . . . 0.0 110.527 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.444 ' HA ' ' CZ3' ' A' ' 44' ' ' TRP . 1.6 pm0 -70.87 59.8 0.23 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.954 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -145.17 106.53 4.21 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.964 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . 0.677 ' HG2' ' HA ' ' A' ' 44' ' ' TRP . 1.9 tp-100 -158.54 53.32 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.255 0.55 . . . . 0.0 110.661 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -85.21 112.22 20.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.277 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -164.3 131.1 2.34 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.555 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.2 mtt -124.96 139.97 53.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.907 0.384 . . . . 0.0 111.612 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.5 p -174.59 133.57 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.087 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.434 ' HB2' ' CE2' ' B' ' 172' ' ' TRP . 10.1 pt-20 -158.15 172.1 19.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.93 0.395 . . . . 0.0 111.746 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.433 HG23 ' HB2' ' B' ' 172' ' ' TRP . 11.2 t -109.21 -66.99 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.548 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.418 ' HB2' ' CE ' ' B' ' 170' ' ' LYS . . . 68.87 73.89 0.26 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.026 0.441 . . . . 0.0 111.783 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.27 -34.4 10.02 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.052 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -94.14 120.52 34.51 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.718 0.294 . . . . 0.0 110.623 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 6.6 pt -133.24 70.46 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.243 0.544 . . . . 0.0 111.816 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -113.46 160.39 18.5 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.599 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.2 tpp -75.47 60.87 1.22 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.868 0.366 . . . . 0.0 111.05 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -108.0 -70.44 0.8 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.135 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 37.75 -113.3 0.22 Allowed Glycine 0 C--N 1.342 0.914 0 CA-C-N 116.301 -0.408 . . . . 0.0 112.656 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 6.9 m 58.31 -148.23 0.48 Allowed 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' B' ' 166' ' ' ALA . 41.2 m-85 64.56 -80.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.421 0.288 . . . . 0.0 111.512 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' B' ' 165' ' ' PHE . . . 172.38 -71.84 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.116 0.484 . . . . 0.0 111.153 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.635 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . 28.7 t0 -60.78 -35.06 75.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.106 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.458 ' HB3' ' O ' ' B' ' 167' ' ' ASP . 4.1 tt0 71.44 -97.53 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.855 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 62.82 -170.26 0.18 Allowed 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.767 0.318 . . . . 0.0 111.258 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.418 ' CE ' ' HB2' ' B' ' 156' ' ' ALA . 6.4 mtmm -137.93 -166.66 2.0 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.792 0.329 . . . . 0.0 111.534 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' B' ' 172' ' ' TRP . 12.0 p-10 -96.68 110.16 22.66 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.434 ' CE2' ' HB2' ' B' ' 154' ' ' GLU . 64.5 p-90 . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.228 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.742 " H3'" ' H72' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.44 0.673 0 C3'-C2'-C1' 105.923 2.302 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.742 ' H72' " H3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.732 0 OP1-P-O3' 111.013 1.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.58 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.41 1.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.651 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 107.136 -1.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.616 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 C4'-C3'-C2' 104.711 1.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.688 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C4'-C3'-C2' 104.338 1.138 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.646 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.56 0 C3'-C2'-C1' 104.397 1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.646 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 N19-C1'-C2' 115.255 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.529 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 C3'-C2'-C1' 104.163 1.045 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.488 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.411 -0.671 0 C3'-C2'-C1' 105.354 1.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.488 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 N19-C1'-C2' 112.833 -0.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 106.907 0.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C1'-O4'-C4' 110.606 0.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.655 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.741 0 C4'-C3'-C2' 104.792 1.592 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.655 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O4'-C4'-C3' 106.189 0.589 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.669 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C4'-C3'-C2' 101.675 -1.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.669 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.759 0 O4'-C4'-C3' 104.503 -1.097 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.695 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C4'-C3'-C2' 104.814 1.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.695 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.526 0.802 0 C1'-O4'-C4' 107.235 -1.761 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.534 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C3'-C2'-C1' 104.308 1.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.534 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 C3'-C2'-C1' 104.992 1.637 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.484 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.738 0.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.478 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.944 0 C1'-O4'-C4' 107.035 -1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.42 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.427 1.234 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.406 ' C2 ' ' C2 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.923 0 C4'-C3'-C2' 104.213 1.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.47 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C1'-O4'-C4' 110.546 0.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 mmt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.397 0.141 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 1.5 mmtt 69.74 112.63 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 O-C-N 123.639 0.587 . . . . 0.0 110.918 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' B' ' 108' ' ' THR . 13.5 tp60 -95.36 121.56 37.15 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.023 ' HG3' HG22 ' B' ' 108' ' ' THR . 1.0 OUTLIER -77.68 102.95 7.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 121.499 0.666 . . . . 0.0 111.573 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.78 HD11 HG11 ' A' ' 28' ' ' VAL . 1.1 pt -100.79 111.57 30.88 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 176.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.567 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -116.54 120.48 38.87 Favored 'General case' 0 C--N 1.313 -1.02 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.846 -176.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.758 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -100.43 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 176.31 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.9 OUTLIER -68.06 79.94 0.22 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.62 0.724 . . . . 0.0 110.417 -178.578 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.032 HG21 ' CD2' ' A' ' 14' ' ' TYR . 18.6 m -75.54 -145.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.701 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.682 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.94 -12.61 0.33 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.0 m -118.72 -62.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.09 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.875 ' HB2' ' CB ' ' B' ' 129' ' ' SER . 1.3 p30 -47.5 -91.84 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -175.87 41.19 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.423 -0.798 . . . . 0.0 111.342 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.088 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -79.16 -41.8 27.63 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.588 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -48.59 -46.33 39.2 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -176.718 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.874 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -47.92 -33.88 8.26 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.598 0.713 . . . . 0.0 112.304 179.547 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.978 HD13 HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -77.4 -60.48 2.35 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.705 179.577 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.588 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -59.41 -25.65 64.49 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.308 179.51 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HB3' ' HB2' ' A' ' 67' ' ' ASP . . . -59.12 -31.32 68.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.232 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.863 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -93.78 -27.95 16.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.565 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 27.5 t70 121.46 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.133 0.973 . . . . 0.0 110.812 176.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.978 HG13 HD13 ' A' ' 17' ' ' LEU . 8.5 p -150.25 77.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.565 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.966 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -73.54 51.98 0.37 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 0.0 111.935 -179.898 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.002 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 40.75 -2.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 118.479 2.77 . . . . 0.0 118.479 178.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.536 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 3.9 p -38.19 -62.96 0.52 Allowed 'General case' 0 C--O 1.24 0.587 0 CA-C-N 119.479 1.036 . . . . 0.0 110.378 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.424 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -85.64 -34.41 13.73 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.988 177.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.615 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -53.4 -61.34 2.36 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 120.825 0.345 . . . . 0.0 110.592 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.002 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -50.99 -68.24 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.473 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.635 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.4 m -50.09 -41.27 47.89 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 2.0 m -70.03 -51.63 30.6 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -56.12 -38.73 71.17 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.549 178.626 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.909 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.0 mtt -60.32 -56.17 24.68 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.82 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -48.85 -40.86 31.17 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.052 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -63.62 -57.06 11.27 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -10.09 59.21 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.093 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -87.0 -37.65 17.31 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -50.33 19.24 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.996 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.459 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 0.3 OUTLIER -72.75 -17.98 61.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 113.948 -1.478 . . . . 0.0 111.876 -178.687 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.011 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.7 OUTLIER -13.98 120.71 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.513 1.125 . . . . 0.0 113.73 179.58 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.61 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -137.1 -66.16 0.52 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.62 ' HA ' ' CA ' ' B' ' 167' ' ' ASP . . . 92.1 120.07 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.984 0.514 . . . . 0.0 111.834 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.61 ' HB2' ' HB2' ' B' ' 169' ' ' ASN . 2.4 mt-10 -139.87 -71.52 0.38 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.577 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.576 ' HD3' ' O ' ' B' ' 171' ' ' ASP . 7.0 ptp180 176.52 107.01 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.701 0.286 . . . . 0.0 111.153 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' B' ' 168' ' ' GLU . 4.3 t90 -116.49 138.03 51.71 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.777 0.322 . . . . 0.0 111.704 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 152.79 18.61 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.678 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.459 ' O ' ' CB ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -108.76 154.82 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.959 179.148 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.459 ' CB ' ' O ' ' A' ' 46' ' ' VAL . 3.6 tp10 90.88 152.82 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.306 0.643 . . . . 0.0 111.233 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -122.8 142.58 50.59 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.627 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.54 1.67 10.65 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -119.21 149.33 41.93 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.772 0.32 . . . . 0.0 111.03 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.568 ' O ' HG23 ' A' ' 53' ' ' VAL . . . -145.51 44.25 0.88 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.724 -0.751 . . . . 0.0 113.328 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.42 ' O ' ' NH2' ' B' ' 137' ' ' ARG . 3.2 mmt -63.8 116.9 6.2 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.895 0.378 . . . . 0.0 110.882 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 51' ' ' GLY . 2.7 t -130.3 43.3 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.69 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HA ' ' CB ' ' A' ' 72' ' ' TRP . 0.7 OUTLIER -152.66 147.75 26.49 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 111.4 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 55' ' ' VAL . 10.1 p -168.16 50.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.596 0.712 . . . . 0.0 110.81 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.19 67.12 0.44 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.317 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -137.96 179.7 6.28 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.065 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -83.81 -75.99 0.31 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.913 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.8 pt 28.0 72.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.98 129.84 24.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.045 0.45 . . . . 0.0 110.976 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.464 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 1.4 mtp 173.45 -33.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.745 -179.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.466 ' O ' ' NH2' ' B' ' 138' ' ' ARG . 1.1 t-20 77.09 -170.25 0.07 Allowed 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.133 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.449 ' O ' ' HB3' ' A' ' 64' ' ' SER . . . 106.02 59.52 0.62 Allowed Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.343 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 78.3 p 174.14 59.58 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.823 0.344 . . . . 0.0 110.493 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -166.08 52.76 0.09 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.929 0.395 . . . . 0.0 111.726 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.821 ' HB3' HD13 ' B' ' 139' ' ' LEU . . . -146.79 -59.74 0.29 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.027 0.441 . . . . 0.0 111.036 179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.786 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -87.02 -32.64 19.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.611 178.666 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -147.29 156.91 43.35 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.098 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -85.31 149.81 25.2 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 121.012 0.434 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HA ' ' CZ2' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -73.3 56.2 0.47 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.683 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -104.64 105.42 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.233 0.539 . . . . 0.0 111.04 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.498 ' CZ2' ' HA ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.129 -0.939 . . . . 0.0 110.775 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.477 ' CG ' ' H62' ' C' ' 173' ' ' ' DA' . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 CA-C-O 120.458 0.17 . . . . 0.0 111.429 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.546 ' HE2' " H3'" ' C' ' 175' ' ' ' DA' . 8.4 mttm -100.92 -171.25 1.97 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.675 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -105.97 100.34 9.9 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.459 0.647 . . . . 0.0 110.86 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.734 ' O ' " H3'" ' D' ' 191' ' ' ' DT' . 4.1 ttp180 -78.99 99.45 6.86 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.337 0.589 . . . . 0.0 110.632 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.088 HD13 ' CD1' ' A' ' 14' ' ' TYR . 21.8 pt -104.31 129.88 55.95 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.784 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 177.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.682 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.4 OUTLIER -131.35 125.83 33.68 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.428 -0.909 . . . . 0.0 112.84 -176.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.763 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.8 98.29 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 1.023 HG22 ' HG3' ' A' ' 4' ' ' ARG . 68.1 p -66.87 95.79 0.39 Allowed 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.0 HG21 ' CB ' ' B' ' 114' ' ' TYR . 2.9 t -85.77 -128.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.915 -178.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.599 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 24.0 t70 82.66 -12.56 0.89 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.923 0.783 . . . . 0.0 108.939 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -125.12 -61.44 1.29 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.01 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.804 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -44.4 -94.4 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.577 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.415 ' N ' ' HB3' ' A' ' 29' ' ' SER . 34.2 t 179.42 41.75 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.871 0.759 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.0 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.51 -45.32 13.72 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.649 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.5 mt-30 -48.89 -39.27 25.31 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -174.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.637 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -58.29 -52.62 64.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.239 0.927 . . . . 0.0 111.752 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.909 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -49.07 -49.97 38.97 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.432 0.634 . . . . 0.0 111.422 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.649 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 2.1 pttt -76.01 -29.25 58.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.474 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' B' ' 116' ' ' LEU . . . -64.12 -28.18 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.083 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.011 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.72 -42.75 12.41 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 118.819 -0.61 . . . . 0.0 109.699 178.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.63 ' CB ' ' HB3' ' B' ' 166' ' ' ALA . 0.2 OUTLIER 155.89 15.49 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 176.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.702 HG22 ' HB2' ' B' ' 164' ' ' SER . 76.0 t -154.19 91.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 121.816 -0.552 . . . . 0.0 111.777 -177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.571 ' HB2' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -57.51 -88.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 178.349 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.008 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -154.72 -0.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 115.864 1.801 . . . . 0.0 115.864 179.039 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.448 ' C ' ' O ' ' B' ' 124' ' ' ILE . 22.0 p -39.46 -63.16 0.59 Allowed 'General case' 0 C--O 1.241 0.62 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.563 -179.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.82 -30.11 24.5 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 121.293 -0.48 . . . . 0.0 112.214 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.676 ' HB3' HG22 ' B' ' 124' ' ' ILE . 5.8 tp -58.59 -61.03 2.9 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.776 0.288 . . . . 0.0 110.33 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.008 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.5 t -51.37 -64.63 0.33 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.012 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.875 ' CB ' ' HB2' ' A' ' 12' ' ' ASP . 7.8 p -48.41 -45.0 35.53 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -46.63 51.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 25.4 m -60.64 -37.9 83.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.917 178.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.85 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.79 -58.4 8.74 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.978 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -58.79 -36.06 73.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.888 -178.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -74.07 -49.51 23.73 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.529 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.756 ' HG3' HD21 ' A' ' 17' ' ' LEU . 21.6 tp10 -69.95 -20.24 63.34 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.874 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.36 -52.78 5.01 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 13.8 mtt180 -57.28 -56.62 19.5 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 121.503 0.668 . . . . 0.0 110.2 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.97 ' HD2' ' HB2' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -72.57 -35.82 68.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.623 179.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.831 HD21 ' CG ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 41.87 70.01 0.31 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.963 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.554 ' CB ' ' O ' ' B' ' 139' ' ' LEU . 19.6 tpp180 119.71 78.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.152 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.97 ' HB2' ' HD2' ' B' ' 138' ' ' ARG . . . -157.44 160.09 37.98 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.683 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.93 -69.05 0.77 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.534 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.27 128.86 20.27 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.765 0.317 . . . . 0.0 111.058 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 7.9 t-105 -162.42 151.4 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.246 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -128.97 -88.99 0.52 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 15.1 t 60.96 65.01 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.241 0.543 . . . . 0.0 111.435 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -93.04 -26.99 17.25 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.643 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 78.94 179.47 0.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.916 0.388 . . . . 0.0 111.41 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -105.6 116.19 31.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.84 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.98 -57.28 3.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.251 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -177.62 -138.82 3.14 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.768 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.44 161.36 17.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.692 0.282 . . . . 0.0 111.13 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.678 HG22 HG23 ' B' ' 155' ' ' VAL . 7.9 p -69.94 125.61 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.084 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -87.61 -63.23 1.34 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.434 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.678 HG23 HG22 ' B' ' 153' ' ' VAL . 46.2 t 77.18 92.53 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.01 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -159.23 135.73 9.22 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.992 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 153.84 29.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.1 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.455 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 1.7 t80 -140.9 162.46 35.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.363 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.455 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 5.3 mt 76.94 135.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.299 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.63 -27.81 18.81 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.535 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -52.95 57.09 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.684 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -177.45 -60.81 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . 0.547 ' HA3' ' CZ ' ' B' ' 165' ' ' PHE . . . 119.49 107.63 2.23 Favored Glycine 0 C--N 1.336 0.579 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.631 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.702 ' HB2' HG22 ' B' ' 122' ' ' VAL . 18.7 p -90.08 68.34 7.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.027 0.441 . . . . 0.0 111.551 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.547 ' CZ ' ' HA3' ' B' ' 163' ' ' GLY . 0.2 OUTLIER -123.04 62.84 1.0 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.089 0.471 . . . . 0.0 110.762 179.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.63 ' HB3' ' CB ' ' B' ' 121' ' ' ASP . . . -136.42 44.36 2.41 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.153 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.62 ' CA ' ' HA ' ' A' ' 41' ' ' ALA . 23.0 t0 -171.82 -74.83 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.905 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.624 ' HB3' ' CD1' ' A' ' 44' ' ' TRP . 0.3 OUTLIER -56.82 156.77 6.19 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.102 0.477 . . . . 0.0 111.595 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.61 ' HB2' ' HB2' ' A' ' 42' ' ' GLU . 55.9 t-20 -135.52 143.5 45.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.195 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.417 ' NZ ' ' OD2' ' B' ' 171' ' ' ASP . 6.2 tptp -169.71 -46.06 0.02 OUTLIER 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.738 ' HB3' ' CE3' ' B' ' 172' ' ' TRP . 0.3 OUTLIER -158.01 -90.26 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.738 ' CE3' ' HB3' ' B' ' 171' ' ' ASP . 44.6 p90 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.241 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.728 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 105.751 2.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.759 H2'' " O5'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.784 0 C3'-C2'-C1' 106.319 2.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.759 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.522 0 O4'-C1'-C2' 107.161 0.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.581 ' H71' " H2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C4'-C3' 106.413 0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.605 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C4'-C3'-C2' 104.652 1.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.61 ' H71' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C4'-C3'-C2' 104.648 1.448 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.661 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 104.621 1.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.486 H2'' ' C8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 O4'-C1'-C2' 104.842 -1.144 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.798 " H3'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C3'-C2'-C1' 104.566 1.333 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.722 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.765 0 C3'-C2'-C1' 105.442 1.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.722 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 O4'-C1'-C2' 107.126 0.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.592 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 N19-C1'-C2' 115.338 0.711 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 O4'-C1'-C2' 106.974 0.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.798 ' OP3' " H3'" ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-C2' 107.382 1.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.778 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 C4'-C3'-C2' 102.387 -0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.778 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.491 0 O4'-C4'-C3' 106.164 0.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.501 ' OP1' ' HG3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 O4'-C1'-C2' 106.645 0.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.536 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.008 0 C1'-O4'-C4' 107.088 -1.866 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.734 " H3'" ' O ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.226 1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.648 ' H62' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C3'-C2'-C1' 106.008 2.363 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.537 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 104.289 1.135 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.425 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C1'-C2' 107.261 1.056 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.42 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C1'-O4'-C4' 107.117 -1.845 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.494 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.631 0 C1'-O4'-C4' 110.757 0.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.494 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 104.011 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 102.063 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.531 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 1' ' ' MET . 5.9 mmtm 74.22 120.24 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.931 0.492 . . . . 0.0 110.872 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' B' ' 109' ' ' VAL . 1.7 tt0 -109.83 108.82 19.27 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.028 0.442 . . . . 0.0 110.235 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.803 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 3.1 ttm105 -79.63 110.15 14.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.969 . . . . 0.0 112.239 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.94 HD11 HG13 ' B' ' 107' ' ' VAL . 0.4 OUTLIER -104.82 130.95 55.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 176.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.76 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -131.48 130.02 41.9 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.435 -1.306 . . . . 0.0 113.523 -177.213 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.898 HG21 ' HB ' ' B' ' 128' ' ' VAL . 0.9 OUTLIER -99.51 98.21 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.619 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.501 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 1.2 p -71.08 67.42 0.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.581 0.705 . . . . 0.0 109.529 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 10' ' ' ASP . 7.1 p -88.83 -131.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-O 117.433 -1.27 . . . . 0.0 109.961 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 9' ' ' VAL . 32.3 t70 114.43 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 119.759 1.163 . . . . 0.0 110.975 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.475 ' H ' HG22 ' A' ' 9' ' ' VAL . 63.1 p 173.64 -27.29 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.524 -1.217 . . . . 0.0 113.379 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.741 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 33.0 m-20 -80.89 70.06 7.6 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.249 -0.981 . . . . 0.0 112.118 -177.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.542 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 34.5 m 57.46 -11.92 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 178.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.823 ' CE1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -56.84 -53.77 54.07 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.113 0.87 . . . . 0.0 109.868 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.2 mt-30 -49.35 -42.24 41.25 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.476 -178.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -53.63 -56.06 20.5 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.371 0.532 . . . . 0.0 111.843 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.787 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -48.06 -47.55 33.82 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.121 -179.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.782 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 22.8 pttt -79.42 -30.5 42.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.178 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.06 -26.39 68.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.862 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.912 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.02 -43.94 11.35 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 118.636 -0.697 . . . . 0.0 109.481 178.418 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 154.49 22.86 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 176.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.449 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 74.4 t -157.93 90.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 CA-C-O 120.785 0.326 . . . . 0.0 110.642 -178.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.782 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -57.22 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.404 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.09 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -150.08 -2.21 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 179.866 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.618 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 55.6 p -39.61 -65.01 0.42 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.896 -177.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.605 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.66 -24.33 50.33 Favored Glycine 0 C--O 1.228 -0.25 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.603 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -64.24 -62.27 1.72 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 122.482 0.313 . . . . 0.0 111.324 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.09 HG23 ' CG2' ' A' ' 24' ' ' ILE . 3.5 t -53.18 -62.74 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 O-C-N 123.02 0.2 . . . . 0.0 110.815 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.807 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 12.9 p -48.35 -40.04 24.15 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -75.7 -45.82 34.68 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.416 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.66 ' HB ' HD21 ' B' ' 127' ' ' LEU . 1.9 p -57.84 -45.01 86.86 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 178.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.131 ' HA ' HD12 ' B' ' 117' ' ' LEU . 4.0 mmt -57.5 -57.19 13.77 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.151 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.428 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.3 OUTLIER -57.91 -39.83 78.89 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -63.65 -57.27 10.59 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.843 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.65 ' OE1' HD11 ' B' ' 117' ' ' LEU . 5.8 mt-10 -70.97 -14.49 62.38 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.825 178.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.812 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -87.22 -28.85 22.13 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 120.998 0.428 . . . . 0.0 110.822 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -49.84 10.9 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.974 0.893 . . . . 0.0 109.277 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.22 -42.28 31.8 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 113.884 -1.507 . . . . 0.0 112.554 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.07 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 32.1 52.25 0.24 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.385 0.674 . . . . 0.0 112.483 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 1.5 mmt180 178.54 35.24 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.99 0.424 . . . . 0.0 111.733 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -118.14 42.0 2.79 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.906 0.384 . . . . 0.0 111.257 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' HG2' ' HD3' ' A' ' 43' ' ' ARG . 6.1 pm0 -66.04 57.92 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.229 0.538 . . . . 0.0 111.697 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.49 ' HD3' ' HG2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 176.99 117.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.732 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -82.2 -83.36 0.13 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.138 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.758 ' HA ' ' HE2' ' B' ' 145' ' ' LYS . 9.7 ptpt -163.08 159.85 23.69 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.985 0.422 . . . . 0.0 111.926 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.4 m -132.68 54.46 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.281 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.94 81.37 0.21 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.685 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -106.39 -168.87 1.48 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.354 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -84.36 -58.54 2.71 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 72.08 116.62 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.144 0.497 . . . . 0.0 111.493 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -179.13 156.33 18.26 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.86 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.9 mtt 64.23 29.53 13.82 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.68 0.276 . . . . 0.0 111.56 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m -125.37 76.77 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 120.953 0.406 . . . . 0.0 111.071 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 53' ' ' VAL . 1.7 mp0 67.48 -71.17 0.11 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.228 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.555 ' HA ' ' CD1' ' A' ' 72' ' ' TRP . 3.1 t 45.37 45.41 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 112.018 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -47.2 -57.74 4.83 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.747 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.541 ' O ' ' CB ' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -143.93 161.19 39.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.191 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 57' ' ' ARG . 76.3 t80 147.55 -52.31 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.935 0.494 . . . . 0.0 111.332 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 pt -67.59 67.57 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -148.24 159.01 44.41 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.152 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 75.6 mtp -79.49 72.6 6.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.903 0.382 . . . . 0.0 111.267 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.45 129.15 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.231 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.515 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -92.02 160.79 26.36 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.938 -0.648 . . . . 0.0 113.042 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 3.8 m 73.86 145.52 0.08 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.121 0.486 . . . . 0.0 111.857 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -156.25 146.7 21.64 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.637 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -171.85 -120.78 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.072 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.16 131.97 55.22 Favored 'General case' 0 C--N 1.331 -0.231 0 O-C-N 122.274 -0.266 . . . . 0.0 110.549 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -150.35 -69.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 6.2 p-10 -117.57 -73.91 0.63 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.711 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER 158.29 -39.68 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.123 0.569 . . . . 0.0 111.467 179.016 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.424 ' HB3' ' CD1' ' A' ' 72' ' ' TRP . 71.0 m-20 63.6 -80.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.535 0.522 . . . . 0.0 111.693 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.555 ' CD1' ' HA ' ' A' ' 55' ' ' VAL . 3.8 p-90 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.91 -0.567 . . . . 0.0 110.678 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.436 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 119.71 -0.185 . . . . 0.0 111.149 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.01 119.28 28.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.202 0.525 . . . . 0.0 111.613 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.723 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.8 OUTLIER -111.04 108.29 17.97 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.526 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.858 ' NH2' HG21 ' B' ' 106' ' ' THR . 5.0 ttp180 -77.44 104.67 8.1 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.474 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.018 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -95.61 109.17 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.668 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.858 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -117.95 116.94 27.94 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 118.759 -1.176 . . . . 0.0 113.158 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.94 HG13 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -100.73 103.18 14.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.803 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 17.9 p -70.33 87.3 0.61 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.777 0.799 . . . . 0.0 110.249 -178.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.334 HG21 ' CD1' ' B' ' 114' ' ' TYR . 19.7 m -72.78 -137.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.912 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.671 ' N ' HG23 ' B' ' 109' ' ' VAL . 26.9 t0 92.3 -8.43 0.2 Allowed 'General case' 0 C--N 1.356 0.864 0 CA-C-O 121.458 0.646 . . . . 0.0 109.603 -177.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 6.1 t -136.47 -55.24 0.74 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.489 177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.807 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -44.04 -94.25 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -177.625 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 32' ' ' MET . 0.1 OUTLIER 176.48 37.56 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.963 0.802 . . . . 0.0 110.939 -179.508 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.334 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -83.22 -43.97 15.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -179.293 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.732 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 2.2 mm100 -47.55 -37.46 12.3 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -174.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.812 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -64.32 -56.96 10.93 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.053 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 1.131 HD12 ' HA ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -52.33 -41.42 62.98 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.255 -177.142 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.732 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.3 OUTLIER -79.38 -29.37 42.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.627 -179.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -64.38 -30.63 71.67 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.39 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.07 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.95 -40.47 13.02 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.499 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 22.2 t70 170.2 15.01 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.933 ' HB ' HD22 ' B' ' 117' ' ' LEU . 51.4 t -135.45 76.15 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 121.333 -0.854 . . . . 0.0 113.101 -177.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.115 ' O ' HD12 ' B' ' 124' ' ' ILE . 1.8 m120 -66.06 57.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.115 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.2 OUTLIER 50.99 -26.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -37.96 -64.22 0.42 Allowed 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.395 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.632 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.37 -20.77 53.92 Favored Glycine 0 C--O 1.227 -0.332 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.415 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.802 ' HG ' HD13 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.39 -60.35 4.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.998 HG23 HG22 ' B' ' 124' ' ' ILE . 74.8 t -54.1 -65.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 120.383 -0.527 . . . . 0.0 109.719 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.741 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 52.5 p -49.17 -46.95 46.14 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -75.41 -50.33 16.21 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 119.376 0.989 . . . . 0.0 110.358 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.662 ' HB ' HD22 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.12 -44.14 74.73 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.435 -179.356 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.894 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.7 mmt -52.35 -45.66 65.78 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.203 178.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.542 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -52.93 -48.0 67.63 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.904 0.383 . . . . 0.0 111.535 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.7 -51.59 67.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.528 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 1.3 mm-40 -77.4 -9.29 58.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.977 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -88.05 -33.97 18.13 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -55.67 5.45 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 121.782 0.801 . . . . 0.0 109.354 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.517 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 4.6 mmp_? -84.56 -38.07 20.43 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 114.123 -1.399 . . . . 0.0 113.457 -178.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.912 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 43.97 60.79 2.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.033 0.533 . . . . 0.0 111.354 -177.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -163.85 5.29 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' B' ' 140' ' ' ARG . . . 74.69 81.08 0.11 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.798 0.439 . . . . 0.0 111.713 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.443 ' HG3' ' HG3' ' B' ' 138' ' ' ARG . 1.9 mm-40 -90.64 155.0 19.17 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.3 mtm105 177.98 -174.03 0.14 Allowed 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.615 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 124.07 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER 177.96 -69.8 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.841 178.363 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 19.5 t 48.02 55.23 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 121.596 0.712 . . . . 0.0 110.168 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.495 ' HB2' ' HD3' ' B' ' 145' ' ' LYS . 3.7 tt0 -108.42 -152.72 0.49 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.576 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -144.24 126.46 15.65 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.834 0.349 . . . . 0.0 110.788 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -166.61 130.54 2.02 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.947 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.22 -61.26 1.41 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 130.48 101.52 0.92 Allowed Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.518 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpt -109.19 -19.88 13.17 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.64 -73.21 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.79 138.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.624 0.578 . . . . 0.0 111.852 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.8 t -147.39 46.82 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.128 -179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.87 112.93 17.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -51.29 2.88 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.251 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -110.99 76.81 1.0 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.632 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 8.7 pt 44.11 39.15 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -83.65 79.6 9.39 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.347 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -166.49 -39.26 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . 0.415 ' ND2' ' HA3' ' B' ' 126' ' ' GLY . 1.4 t30 70.27 -171.91 0.17 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.674 0.273 . . . . 0.0 110.943 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -128.24 92.58 0.35 Allowed Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.785 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.711 ' HB3' ' HB3' ' B' ' 168' ' ' GLU . 2.5 p -100.48 142.67 31.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.795 0.331 . . . . 0.0 111.657 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -100.16 -49.38 4.3 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -109.6 -56.17 2.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.03 0.443 . . . . 0.0 111.121 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' B' ' 164' ' ' SER . 5.1 m-20 -133.39 -99.42 0.27 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.944 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.711 ' HB3' ' HB3' ' B' ' 164' ' ' SER . 0.8 OUTLIER 61.71 -69.4 0.05 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 179.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 167' ' ' ASP . 0.0 OUTLIER -166.39 156.69 12.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.703 0.287 . . . . 0.0 110.851 -179.736 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' B' ' 170' ' ' LYS . 3.0 tptp -102.07 176.59 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.245 0.545 . . . . 0.0 112.077 -178.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.496 ' O ' ' HB3' ' B' ' 172' ' ' TRP . 0.7 OUTLIER -69.9 100.33 1.55 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.641 -179.532 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.496 ' HB3' ' O ' ' B' ' 171' ' ' ASP . 22.7 t90 . . . . . 0 C--O 1.252 1.199 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.629 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.854 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.44 0.694 0 O4'-C1'-C2' 107.163 0.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.854 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.639 0 P-O3'-C3' 120.82 0.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.598 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.574 0 C1'-O4'-C4' 110.653 0.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.418 ' C4 ' ' C5 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.889 0 C4'-C3'-C2' 104.761 1.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.651 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.89 0 C4'-C3'-C2' 104.71 1.51 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.651 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.781 0 C4'-C3'-C2' 104.559 1.359 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.692 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 O4'-C1'-C2' 107.087 0.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.485 H2'' ' C8 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C4'-C3'-C2' 104.442 1.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.485 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 O4'-C1'-C2' 106.9 0.727 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.49 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.732 0 C3'-C2'-C1' 105.534 2.024 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.588 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-C2' 107.054 0.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.588 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 105.158 -0.856 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C1'-O4'-C4' 110.264 0.403 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.778 ' OP3' " H3'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.58 0 O4'-C1'-C2' 107.031 0.847 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.778 " H3'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C4'-C3'-C2' 102.606 -0.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.478 ' OP2' ' HG3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 106.844 0.676 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.706 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C4'-C3'-C2' 102.289 -0.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.706 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.963 0 C3'-C2'-C1' 104.827 1.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.583 ' H73' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-C2' 107.374 1.159 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.482 ' N6 ' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.855 1.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.516 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.41 -0.788 0 C3'-C2'-C1' 105.384 1.917 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.493 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.557 0 C3'-C2'-C1' 104.324 1.16 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.451 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 C1'-O4'-C4' 107.372 -1.663 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.41 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 C1'-O4'-C4' 111.101 1.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.819 0 C4'-C3'-C2' 104.592 1.392 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 O4'-C1'-C2' 107.255 1.05 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 120.225 0.059 . . . . 0.0 111.124 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.34 144.58 17.21 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.658 0.266 . . . . 0.0 110.945 179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.781 ' HB3' ' CB ' ' B' ' 110' ' ' ASP . 1.4 tp60 -114.55 129.11 56.64 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.762 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.89 ' NH2' HG21 ' A' ' 6' ' ' THR . 15.1 ttp85 -78.31 99.41 6.31 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.714 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.804 HG21 ' CG ' ' B' ' 114' ' ' TYR . 1.3 pt -94.61 113.86 30.01 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.236 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.713 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.89 HG21 ' NH2' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -119.6 122.69 42.14 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 119.092 -1.043 . . . . 0.0 112.581 -178.013 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.93 HG12 HG22 ' B' ' 105' ' ' ILE . 2.1 p -99.23 106.75 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 114.242 -1.345 . . . . 0.0 107.936 177.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.799 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.7 OUTLIER -70.1 68.09 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.098 0.951 . . . . 0.0 108.6 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.832 HG21 ' CB ' ' A' ' 14' ' ' TYR . 9.8 p -72.54 -142.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.581 -1.645 . . . . 0.0 112.895 -177.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.674 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 7.1 t70 86.61 -5.3 0.72 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.763 0.792 . . . . 0.0 109.311 -176.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.46 -73.03 0.66 Allowed 'General case' 0 N--CA 1.457 -0.086 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.341 177.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.0 m-20 -32.94 -77.26 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.789 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.478 ' N ' ' HB2' ' B' ' 129' ' ' SER . 1.8 m 167.22 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.188 0.518 . . . . 0.0 111.106 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.913 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -84.6 -47.14 10.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 179.728 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.9 mt-30 -48.91 -38.94 24.23 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -174.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.68 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.8 OUTLIER -52.07 -57.61 9.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.485 1.038 . . . . 0.0 111.574 179.17 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.003 ' CD1' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -55.4 -44.25 76.01 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.648 -177.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -76.28 -25.65 55.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.065 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -29.27 53.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.732 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.654 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.4 m-30 -87.71 -46.24 9.67 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 177.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 138.51 34.94 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.874 1.359 . . . . 0.0 111.223 177.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.844 HG21 HD21 ' B' ' 139' ' ' LEU . 16.4 t -116.01 76.59 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.014 0.435 . . . . 0.0 111.875 -178.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 16.2 p30 -67.84 44.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER 39.52 1.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 178.044 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' ASN . 6.9 p -38.57 -63.59 0.5 Allowed 'General case' 0 C--O 1.244 0.802 0 CA-C-N 119.048 0.84 . . . . 0.0 110.904 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.422 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -86.22 -21.37 52.36 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.613 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 1.003 HD12 ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -71.2 -62.54 1.36 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.896 0.348 . . . . 0.0 111.223 -179.376 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.028 HG21 HG22 ' B' ' 128' ' ' VAL . 2.1 t -51.05 -62.23 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.679 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 17.8 p -48.83 -31.12 6.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 122.651 0.38 . . . . 0.0 111.842 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -77.06 -57.92 3.57 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 m -52.96 -44.64 67.26 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.158 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.799 ' HA ' ' CD1' ' B' ' 117' ' ' LEU . 3.4 mmt -49.34 -43.55 43.86 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.411 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.569 ' CA ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -63.61 -48.77 75.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.106 0.412 . . . . 0.0 110.44 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -60.82 -53.34 58.51 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.686 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -61.6 -41.8 97.95 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.269 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.783 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -58.46 -44.44 89.26 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.352 178.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.401 ' NH2' ' OE1' ' A' ' 33' ' ' GLN . 4.6 mtt-85 -69.5 -54.53 13.76 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 34' ' ' ASN . 3.8 mmp_? -57.41 -36.68 71.64 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.232 -178.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.033 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 8.39 85.18 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.195 0.998 . . . . 0.0 113.209 179.793 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.415 ' H ' ' HG2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -53.54 124.44 14.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.354 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.34 -70.44 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -178.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -158.2 77.76 0.8 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.881 0.372 . . . . 0.0 111.968 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.458 ' O ' ' HB3' ' A' ' 44' ' ' TRP . 4.1 ttt85 67.63 141.94 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.085 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.458 ' HB3' ' O ' ' A' ' 43' ' ' ARG . 52.4 t90 76.41 134.83 0.06 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.684 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.32 77.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.721 HG13 ' H ' ' A' ' 47' ' ' GLU . 1.5 p -157.27 -91.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.781 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.721 ' H ' HG13 ' A' ' 46' ' ' VAL . 0.8 OUTLIER 66.21 -62.28 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.752 0.251 . . . . 0.0 111.345 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -117.57 -176.18 2.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.884 0.373 . . . . 0.0 111.394 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.2 139.01 31.15 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.485 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -130.1 128.86 42.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.62 -104.79 0.26 Allowed Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.806 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.52 57.04 2.9 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.152 0.501 . . . . 0.0 111.495 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 53.0 t -141.9 109.42 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.846 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -127.53 132.91 49.85 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.964 0.412 . . . . 0.0 111.326 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.487 ' HB ' ' NE1' ' A' ' 72' ' ' TRP . 2.6 t -127.89 56.58 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.181 0.515 . . . . 0.0 110.843 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -132.22 149.03 52.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.404 ' HG3' ' N ' ' A' ' 58' ' ' PHE . 0.5 OUTLIER -81.53 -28.22 34.05 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.799 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.459 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 0.7 OUTLIER -173.82 -76.66 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.085 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' A' ' 58' ' ' PHE . 17.9 tt 169.82 148.84 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.566 0.346 . . . . 0.0 111.191 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.62 -160.99 1.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.892 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.402 ' O ' ' N ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -124.26 -92.22 0.53 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 111.523 0.194 . . . . 0.0 111.523 -179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.3 t30 64.49 -55.51 0.27 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.796 0.438 . . . . 0.0 112.168 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 61' ' ' MET . . . 78.86 -56.45 4.27 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.47 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.416 ' CB ' ' HB3' ' A' ' 68' ' ' GLU . 12.6 m 67.21 -60.29 0.37 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.401 0.28 . . . . 0.0 111.547 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 62.29 48.6 4.7 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -175.55 -105.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.879 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.442 ' CB ' HD12 ' B' ' 139' ' ' LEU . 4.3 p-10 -83.13 48.55 1.39 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.506 0.67 . . . . 0.0 110.561 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.416 ' HB3' ' CB ' ' A' ' 64' ' ' SER . 1.0 OUTLIER 179.23 149.36 0.26 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.821 -179.62 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.427 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 9.7 t-20 -174.08 110.02 0.15 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.513 ' HD3' ' N ' ' A' ' 71' ' ' ASP . 8.7 tmtt? 75.44 152.71 0.13 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.086 0.469 . . . . 0.0 111.874 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.513 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 3.1 t70 -68.11 -160.14 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.556 179.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.487 ' NE1' ' HB ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.015 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.3 tmm? . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 120.655 0.264 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.647 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 15.4 mmtt -138.57 173.0 12.05 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.4 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.674 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 11.5 tp60 -125.97 124.64 41.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.083 0.468 . . . . 0.0 111.231 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.463 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.31 112.24 16.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -179.032 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.934 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -107.16 128.94 61.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.182 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.175 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.789 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -131.47 120.18 22.63 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.696 -179.804 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.67 HG23 HG13 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -103.5 93.69 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 174.342 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.882 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.8 p -70.52 89.31 0.7 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.045 -1.034 . . . . 0.0 109.687 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 21.6 m -141.35 -0.98 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.781 ' CB ' ' HB3' ' A' ' 3' ' ' GLN . 0.0 OUTLIER 17.85 -74.65 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.645 1.111 . . . . 0.0 112.209 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.62 ' N ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -66.7 -20.16 65.91 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -179.143 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.696 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 1.2 t0 -78.72 62.8 3.33 Favored 'General case' 0 C--N 1.347 0.463 0 CA-C-N 120.017 1.28 . . . . 0.0 111.132 -178.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.569 ' HB3' ' CA ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER 58.91 -24.87 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 179.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.804 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.02 -56.52 3.29 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-O 121.708 0.766 . . . . 0.0 110.424 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.591 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 20.3 pt20 -49.54 -39.93 36.37 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.175 -1.375 . . . . 0.0 112.713 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.783 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -60.61 -43.84 97.0 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.664 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.799 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -61.45 -50.03 74.43 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.457 0.646 . . . . 0.0 111.439 -179.314 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.8 pttt -70.13 -25.88 63.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.581 178.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -60.38 -26.67 66.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.54 177.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.033 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -88.41 -44.94 10.38 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.372 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.691 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 150.13 63.0 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 176.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.735 ' CG1' HD23 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -157.6 -42.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 178.649 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.985 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.2 OUTLIER 58.18 59.26 3.13 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.465 0.65 . . . . 0.0 110.014 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.999 ' HB ' HG23 ' B' ' 128' ' ' VAL . 0.5 OUTLIER 40.53 -11.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 118.478 2.77 . . . . 0.0 118.478 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.736 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.03 -56.43 1.15 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.112 -177.888 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.76 -24.63 52.66 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.533 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.87 ' HB3' HG22 ' B' ' 124' ' ' ILE . 1.0 OUTLIER -70.32 -61.48 1.76 Allowed 'General case' 0 C--N 1.343 0.325 0 C-N-CA 122.971 0.509 . . . . 0.0 111.142 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.028 HG22 HG21 ' A' ' 28' ' ' VAL . 71.0 t -46.42 -54.4 2.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.787 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.05 -40.73 86.01 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 90.6 m -74.05 -49.84 22.36 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.606 HG22 ' O ' ' B' ' 128' ' ' VAL . 3.4 t -55.34 -30.86 61.08 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.674 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.844 ' HE1' HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.69 -57.61 11.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.779 179.023 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.75 -46.03 85.07 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -64.54 -50.59 66.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.812 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.593 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -71.84 -25.04 61.81 Favored 'General case' 0 C--O 1.217 -0.642 0 C-N-CA 120.349 -0.54 . . . . 0.0 110.069 178.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.68 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.56 -46.33 59.72 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 177.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -60.17 -56.02 26.66 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.505 0.669 . . . . 0.0 110.126 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.489 ' HD2' ' O ' ' B' ' 139' ' ' LEU . 4.6 tmm_? -77.81 -49.35 14.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.866 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.844 HD21 HG21 ' A' ' 22' ' ' VAL . 0.3 OUTLIER 37.27 -146.41 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.525 0.73 . . . . 0.0 111.924 -178.46 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 21.0 tpp85 -146.49 -84.63 0.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.778 -0.576 . . . . 0.0 111.942 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -179.51 97.08 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.652 0.263 . . . . 0.0 111.333 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -112.92 -45.2 3.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.058 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 77.49 169.88 0.22 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.177 0.513 . . . . 0.0 111.949 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 72.59 65.71 0.12 Allowed 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.35 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 20' ' ' TYR . 2.0 mmtm -134.54 95.14 3.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.159 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.82 52.41 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.251 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.22 -50.2 1.79 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.539 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . 0.403 ' O ' ' CB ' ' B' ' 149' ' ' GLN . 24.0 m120 68.41 177.64 0.25 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.995 0.426 . . . . 0.0 111.975 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' B' ' 148' ' ' ASN . 0.6 OUTLIER 85.0 105.52 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.0 179.744 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . 0.507 ' CG ' ' HG ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -119.76 149.84 41.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.718 179.297 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -72.54 61.19 1.56 Allowed Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.495 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.88 66.42 5.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.155 0.502 . . . . 0.0 110.962 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 13.7 p -164.71 134.92 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.804 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.545 ' HB3' ' CH2' ' B' ' 172' ' ' TRP . 2.4 pp20? -143.46 169.15 18.22 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.851 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.654 HG12 ' HB3' ' B' ' 172' ' ' TRP . 12.3 p -150.69 38.35 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.304 0.573 . . . . 0.0 111.937 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.484 ' C ' ' HG2' ' B' ' 157' ' ' ARG . . . -82.73 99.78 9.85 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.128 -0.357 . . . . 0.0 110.77 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . 0.484 ' HG2' ' C ' ' B' ' 156' ' ' ALA . 39.8 mmt-85 -154.27 135.62 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.565 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.424 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 48.9 m-85 66.08 -53.44 0.4 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 178.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.609 HG21 ' O ' ' B' ' 162' ' ' ASN . 17.1 mt 83.38 156.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.745 0.418 . . . . 0.0 111.224 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.466 ' H ' ' HG3' ' B' ' 160' ' ' GLU . 0.5 OUTLIER -78.71 -51.67 9.49 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.82 -179.635 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -159.58 -44.11 0.05 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . 0.609 ' O ' HG21 ' B' ' 159' ' ' ILE . 13.8 m-80 -57.06 133.04 54.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.94 0.4 . . . . 0.0 111.584 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -104.85 142.18 15.44 Favored Glycine 0 C--N 1.334 0.425 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.865 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.516 ' CB ' ' HG3' ' B' ' 168' ' ' GLU . 0.2 OUTLIER -71.71 64.89 0.48 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.049 0.452 . . . . 0.0 111.552 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -94.81 -1.54 52.6 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.759 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -145.53 105.57 4.03 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.395 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.524 ' O ' ' CB ' ' B' ' 168' ' ' GLU . 19.3 t70 71.49 -56.93 0.62 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.752 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.524 ' CB ' ' O ' ' B' ' 167' ' ' ASP . 32.5 tt0 104.7 100.31 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.191 0.997 . . . . 0.0 110.853 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.83 176.35 9.65 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.268 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 51.93 1.66 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.645 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.21 127.43 31.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.654 ' HB3' HG12 ' B' ' 155' ' ' VAL . 47.6 m0 . . . . . 0 C--O 1.253 1.287 0 CA-C-O 118.568 -0.73 . . . . 0.0 110.925 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.599 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 O4'-C1'-C2' 106.759 0.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.599 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C3'-C2'-C1' 101.219 -1.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.499 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.539 0 O4'-C1'-C2' 107.329 1.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.799 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.953 0 C4'-C3'-C2' 104.66 1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.84 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.861 0 C4'-C3'-C2' 104.866 1.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.84 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 C4'-C3'-C2' 104.761 1.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.631 ' H62' ' NH2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.492 0 C3'-C2'-C1' 105.469 1.978 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.618 ' H72' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 N19-C1'-C2' 115.401 0.75 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.578 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.442 1.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.501 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C3'-C2'-C1' 104.799 1.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.501 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.512 -0.676 0 C4'-C3'-C2' 104.082 0.882 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.445 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O4'-C1'-C2' 106.803 0.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 N19-C1'-C2' 115.061 0.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-C2' 105.339 -0.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.406 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 106.939 0.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.406 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C1'-O4'-C4' 110.422 0.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 O4'-C4'-C3' 106.143 0.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.511 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 104.262 1.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.69 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.895 0 N19-C1'-C2' 115.54 0.838 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.557 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 104.787 1.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.61 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.732 0 C3'-C2'-C1' 105.839 2.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.61 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C3'-C2'-C1' 104.601 1.358 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.416 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.87 0 C1'-O4'-C4' 107.145 -1.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 104.273 1.073 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.791 0 C4'-C3'-C2' 104.252 1.052 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.498 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C4'-C3' 106.129 0.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -81.54 -173.06 4.17 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.035 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.848 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -122.77 110.02 14.94 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.651 0.739 . . . . 0.0 111.528 -179.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.886 ' HG3' HG23 ' B' ' 108' ' ' THR . 3.2 ttm105 -83.64 113.96 21.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.246 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.035 HD11 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -104.51 130.6 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.811 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -126.79 126.01 42.68 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.806 -0.758 . . . . 0.0 112.735 -177.469 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 HG22 ' B' ' 105' ' ' ILE . 0.6 OUTLIER -100.51 109.09 24.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.627 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.561 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 15.2 p -70.67 68.31 0.39 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.683 0.754 . . . . 0.0 109.333 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.835 HG11 ' CB ' ' A' ' 14' ' ' TYR . 8.3 p -76.23 -143.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.253 -1.34 . . . . 0.0 111.795 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.72 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 7.2 t70 87.43 1.56 0.44 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-O 122.067 0.937 . . . . 0.0 109.86 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.5 m -129.24 -64.72 0.89 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.086 -1.416 . . . . 0.0 108.18 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.823 ' HB2' ' HB3' ' B' ' 129' ' ' SER . 1.2 m-20 -42.37 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.998 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m 178.54 41.61 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.607 0.639 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.912 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.5 OUTLIER -82.83 -49.48 9.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -179.166 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 4.1 mm-40 -48.15 -36.55 13.69 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -173.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.99 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -60.8 -53.29 59.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.86 0.754 . . . . 0.0 112.183 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.894 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -49.97 -45.76 51.78 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.236 0.541 . . . . 0.0 111.553 -178.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -77.73 -25.73 49.48 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.852 178.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -62.04 -28.65 69.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.621 178.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.692 ' CZ ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -88.12 -41.93 12.7 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.587 178.386 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.669 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 154.23 14.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 176.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 70.3 t -152.66 92.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 121.794 -0.566 . . . . 0.0 112.086 -177.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.465 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 4.8 p30 -58.41 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.06 HD11 HD12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -146.29 -2.67 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 115.599 1.704 . . . . 0.0 115.599 178.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.453 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -39.29 -64.37 0.47 Allowed 'General case' 0 C--O 1.245 0.82 0 C-N-CA 119.922 -0.711 . . . . 0.0 109.346 -179.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.62 -28.67 26.2 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.058 -0.591 . . . . 0.0 111.964 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.688 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -57.71 -61.12 2.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.597 0.359 . . . . 0.0 110.752 179.238 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.056 HG22 HG21 ' B' ' 124' ' ' ILE . 2.4 t -51.98 -63.72 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.781 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.746 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 5.4 p -49.15 -39.05 27.41 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.5 m -71.88 -58.42 3.48 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.2 m -53.92 -42.84 69.22 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.01 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.002 ' HE1' HG23 ' B' ' 124' ' ' ILE . 11.4 mmt -56.61 -57.3 12.98 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.855 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -38.84 65.34 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -53.5 24.97 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.349 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.794 ' HB3' HD11 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -67.84 -25.94 65.8 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.248 178.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.573 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.93 -43.7 64.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -50.62 72.83 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.079 -0.964 . . . . 0.0 108.939 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.9 OUTLIER -56.79 -57.21 13.44 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.221 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 11.09 -82.97 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.32 1.048 . . . . 0.0 113.377 179.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 1.9 tpt180 63.91 4.04 1.84 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.433 ' HB3' ' CD2' ' A' ' 39' ' ' LEU . . . -71.52 53.32 0.21 Allowed 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.802 -0.561 . . . . 0.0 111.626 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' O ' ' HD2' ' A' ' 43' ' ' ARG . 10.1 pt-20 -83.17 8.4 13.28 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.098 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -137.04 177.77 7.6 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.024 0.44 . . . . 0.0 111.317 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -82.2 168.16 17.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.172 0.51 . . . . 0.0 112.002 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.89 127.19 30.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.498 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 33.2 t -83.29 -71.21 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -171.5 171.01 5.59 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.947 0.403 . . . . 0.0 111.428 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.26 114.28 1.42 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.71 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.15 136.92 53.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.192 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.442 ' HA ' ' CE1' ' B' ' 158' ' ' PHE . 17.9 tt0 70.87 135.31 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.205 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -178.75 115.35 0.49 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.568 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.4 mtt -146.53 54.41 1.12 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.351 0.596 . . . . 0.0 110.066 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.521 ' HB ' ' HG2' ' B' ' 154' ' ' GLU . 9.9 p -93.59 -19.99 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.284 -179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 pp20? -57.41 154.39 10.94 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.082 0.468 . . . . 0.0 111.6 -179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 m -129.23 43.51 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.701 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.512 ' O ' ' HB2' ' A' ' 57' ' ' ARG . . . -103.66 152.81 21.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.848 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER 78.24 165.43 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.626 0.37 . . . . 0.0 110.706 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 67.63 -57.36 0.45 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.765 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.648 HG23 ' H ' ' A' ' 60' ' ' GLU . 7.0 tt -92.17 -66.32 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 59' ' ' ILE . 0.3 OUTLIER 43.96 66.58 0.81 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.504 0.669 . . . . 0.0 111.511 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.426 ' O ' ' NE ' ' B' ' 143' ' ' ARG . 4.7 tpt -77.71 -58.76 3.09 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.55 -0.75 . . . . 0.0 112.324 -179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.77 166.42 21.78 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' B' ' 142' ' ' GLU . . . 175.35 131.39 1.43 Allowed Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.883 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 m -121.48 131.29 54.07 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 117.029 0.415 . . . . 0.0 111.559 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 50.9 -165.03 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.887 0.375 . . . . 0.0 111.347 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.621 ' HA ' ' HA ' ' B' ' 139' ' ' LEU . . . -81.38 -59.41 2.64 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.559 0.695 . . . . 0.0 110.094 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.566 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 9.9 p-10 -126.15 70.95 1.24 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.737 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -172.03 92.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.023 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.41 -174.12 3.95 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.87 162.33 16.49 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.076 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -89.31 -174.25 4.32 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.704 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.035 -0.983 . . . . 0.0 111.279 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 tpt . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 120.711 0.291 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt -142.57 143.76 32.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.363 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.72 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.2 tt0 -113.97 126.25 54.93 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.355 0.598 . . . . 0.0 111.002 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.503 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.86 108.32 11.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.433 -178.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.06 HD12 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -101.59 109.22 25.32 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.962 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.192 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.732 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -116.91 114.97 24.6 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.468 -178.488 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 1.035 HG13 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -101.31 111.94 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.886 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -70.02 91.47 0.68 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -179.704 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.96 HG22 HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -96.28 -158.88 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 112.152 -178.228 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.848 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 13.3 t70 96.71 -5.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.23 -61.55 1.66 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 175.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -49.93 -90.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.692 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 33.3 t -179.68 40.25 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.168 0.895 . . . . 0.0 111.229 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.98 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 1.1 t80 -82.71 -50.13 9.04 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.3 OUTLIER -47.39 -38.41 13.19 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.581 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.573 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.05 -44.0 64.06 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.612 1.096 . . . . 0.0 112.349 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -68.07 -47.76 67.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.075 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.613 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 2.8 pttt -72.06 -29.88 64.58 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.552 0.692 . . . . 0.0 110.483 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -59.98 -28.75 67.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.463 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.72 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -88.46 -42.58 12.04 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.591 -0.719 . . . . 0.0 110.476 179.111 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.6 28.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 177.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.533 ' O ' HD23 ' B' ' 117' ' ' LEU . 68.7 t -160.65 96.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 O-C-N 122.209 -0.307 . . . . 0.0 111.726 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.613 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 2.5 m-20 -60.03 -102.75 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 178.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.056 HG21 HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -145.12 6.83 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 179.037 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.618 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 2.6 p -41.6 -64.25 0.6 Allowed 'General case' 0 C--O 1.243 0.713 0 CA-C-O 121.629 0.728 . . . . 0.0 109.687 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.91 -23.19 42.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.658 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.823 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.47 -57.27 11.83 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.719 0.259 . . . . 0.0 111.018 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.057 HG22 HG21 ' A' ' 24' ' ' ILE . 5.4 t -54.21 -62.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.823 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 14.8 p -50.42 -44.19 55.09 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 87.5 m -68.55 -57.34 5.92 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.465 HG22 ' O ' ' B' ' 128' ' ' VAL . 0.7 OUTLIER -54.0 -44.41 70.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.397 179.594 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.929 ' HE2' HG23 ' A' ' 24' ' ' ILE . 5.3 mtt -60.21 -58.02 10.31 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.438 178.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.433 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.0 OUTLIER -49.35 -44.56 44.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.4 -179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -64.1 -57.4 9.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.565 0.222 . . . . 0.0 110.778 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.445 ' HB2' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.4 -15.18 62.81 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.99 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.69 -29.1 20.13 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 123.234 0.613 . . . . 0.0 111.089 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.58 -48.68 10.7 Favored 'General case' 0 CA--C 1.504 -0.825 0 CA-C-O 121.909 0.861 . . . . 0.0 110.118 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -64.45 -28.45 69.68 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.771 -1.559 . . . . 0.0 114.298 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.942 HD11 ' O ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -50.14 144.86 6.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 119.491 1.042 . . . . 0.0 111.805 -178.659 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.69 -50.85 0.63 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.848 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.94 65.97 1.12 Allowed 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.796 0.331 . . . . 0.0 111.27 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -95.79 146.53 24.47 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -179.397 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.426 ' NE ' ' O ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -155.22 109.81 2.96 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.587 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 6.2 p90 -67.55 133.04 48.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.735 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -177.35 155.4 1.11 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.836 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 58.8 t -60.8 120.29 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.172 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -56.71 149.98 16.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.196 0.522 . . . . 0.0 111.831 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -167.84 148.05 5.05 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.3 60.39 0.1 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.304 0.573 . . . . 0.0 111.097 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -127.46 71.74 1.36 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.66 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -137.97 158.56 24.76 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.881 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.43 ' CG ' HG23 ' A' ' 53' ' ' VAL . 0.0 OUTLIER 65.37 -171.07 0.19 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.759 0.314 . . . . 0.0 111.196 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 7.3 p -143.32 -33.91 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.521 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 2.2 pm0 -81.45 151.21 27.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.272 0.558 . . . . 0.0 111.874 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 2.6 m -144.72 85.04 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.862 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -138.8 164.37 29.78 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.83 152.38 24.94 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.077 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.501 ' CD2' HG12 ' B' ' 159' ' ' ILE . 0.8 OUTLIER -167.28 165.25 15.29 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.538 0.209 . . . . 0.0 111.421 -179.696 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.501 HG12 ' CD2' ' B' ' 158' ' ' PHE . 21.2 mm 44.91 61.87 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.307 0.575 . . . . 0.0 111.189 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.512 ' HG2' ' HA3' ' B' ' 163' ' ' GLY . 0.6 OUTLIER -114.27 -43.24 3.23 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.704 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.34 -66.93 0.28 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.81 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.15 68.07 0.76 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.373 0.606 . . . . 0.0 110.297 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . 0.512 ' HA3' ' HG2' ' B' ' 160' ' ' GLU . . . -159.01 71.59 0.24 Allowed Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.046 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 72.47 179.32 0.23 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.543 0.211 . . . . 0.0 110.655 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.414 ' HB3' HG22 ' B' ' 122' ' ' VAL . 5.4 t80 -125.0 -85.34 0.64 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 121.182 -0.207 . . . . 0.0 111.363 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -107.15 -108.37 0.31 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.421 ' HB2' ' CE1' ' B' ' 120' ' ' TYR . 26.7 t0 64.41 170.52 0.18 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.052 0.453 . . . . 0.0 111.776 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 63.32 179.13 0.15 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.211 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 1.7 p30 -119.13 -92.67 0.53 Allowed 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 177.35 77.04 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.95 -49.56 8.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.819 0.342 . . . . 0.0 110.378 178.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.417 179.235 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.705 H2'' " C5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.178 0 C5'-C4'-O4' 108.363 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.752 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.614 0.598 0 C4'-C3'-C2' 101.862 -1.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.752 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 C3'-C2'-C1' 104.799 1.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.561 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -1.034 0 C1'-O4'-C4' 108.003 -1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.618 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 C3'-C2'-C1' 104.382 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.61 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C4'-C3'-C2' 104.584 1.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.519 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.487 ' H72' ' C8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.711 0 O4'-C1'-C2' 104.797 -1.185 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.461 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 O4'-C1'-C2' 106.933 0.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.484 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.828 0 C1'-O4'-C4' 107.546 -1.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.484 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 N19-C1'-C2' 113.059 -0.713 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 102.04 -0.472 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C1'-O4'-C4' 110.404 0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.432 -0.485 0 O4'-C4'-C3' 104.593 -1.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.43 " O5'" ' C6 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 O4'-C1'-C2' 107.225 1.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.49 H2'' ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-C2' 107.147 0.952 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.671 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O4'--C1' 1.411 -0.728 0 C4'-C3'-C2' 104.435 1.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.477 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.065 0 C3'-C2'-C1' 104.838 1.527 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.51 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 105.341 1.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.538 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 105.594 2.067 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.538 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C4'-C3'-C2' 104.273 1.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.845 0.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.016 0 C4'-C3'-C2' 104.56 1.36 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.4 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 C1'-O4'-C4' 110.888 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.4 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.845 0 C4'-C3'-C2' 104.268 1.068 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C1'-O4'-C4' 110.305 0.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.526 ' C ' ' HB3' ' B' ' 110' ' ' ASP . 6.9 tpp . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -120.16 101.76 8.05 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.065 0.46 . . . . 0.0 111.037 179.023 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.748 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -103.81 111.87 24.57 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.344 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -77.89 105.89 9.38 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.121 -178.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.669 HG12 HG13 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -103.94 120.98 54.91 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.993 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 175.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.738 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -124.76 124.15 41.52 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.894 -177.199 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.792 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.74 108.08 21.99 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 27.3 p -70.64 89.96 0.74 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.753 0.311 . . . . 0.0 110.997 -178.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.004 HG21 ' CB ' ' A' ' 14' ' ' TYR . 3.0 t -84.44 -133.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.928 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.551 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 35.7 t0 85.73 -9.93 0.75 Allowed 'General case' 0 C--N 1.347 0.488 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -176.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.456 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 1.3 t -135.21 -54.19 0.8 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.388 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.755 ' HB2' HG13 ' A' ' 9' ' ' VAL . 1.4 m-20 -47.39 -103.28 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.68 0.992 . . . . 0.0 113.68 -178.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.61 35.32 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.767 0.794 . . . . 0.0 111.05 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.004 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.0 -38.68 22.3 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.595 1.158 . . . . 0.0 112.608 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -48.63 -43.99 36.88 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -176.259 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.79 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -54.35 -44.07 71.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.316 0.962 . . . . 0.0 112.26 -179.41 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.013 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.2 OUTLIER -59.15 -52.38 65.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.622 0.725 . . . . 0.0 111.239 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -74.01 -29.37 61.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.752 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.4 -27.93 69.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.267 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.107 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.3 OUTLIER -88.41 -45.02 10.32 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 118.585 -0.722 . . . . 0.0 110.356 179.096 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.677 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 159.85 18.89 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.029 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.671 ' O ' HD12 ' A' ' 17' ' ' LEU . 65.3 t -157.87 98.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.435 0 CA-C-N 118.411 0.551 . . . . 0.0 112.017 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.588 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 31.1 m-80 -57.31 -96.6 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.032 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.71 5.87 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 178.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.52 ' HB2' " O3'" ' D' ' 189' ' ' ' DG' . 1.2 t -39.34 -64.58 0.45 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.399 -177.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.86 -25.87 28.38 Favored Glycine 0 C--N 1.337 0.598 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.433 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.705 HD12 ' CD1' ' A' ' 17' ' ' LEU . 6.6 tt -58.61 -61.65 2.44 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.992 0.425 . . . . 0.0 109.885 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.032 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.3 t -49.96 -62.8 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.965 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.861 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.897 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 95.4 p -49.45 -43.42 44.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.05 -47.91 40.65 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.254 -0.646 . . . . 0.0 109.254 179.68 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.612 HG21 HG21 ' B' ' 131' ' ' THR . 23.3 m -61.47 -34.59 75.72 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.821 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.6 OUTLIER -63.97 -56.86 12.04 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.79 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.51 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -50.23 -34.13 21.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.69 0.281 . . . . 0.0 110.752 179.504 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.4 m-20 -75.36 -50.29 16.4 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.168 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.724 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 mm-40 -67.76 -23.47 65.23 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.06 178.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.669 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -73.0 -50.12 24.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -56.1 10.42 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.295 178.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.12 -46.03 92.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.394 -178.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.781 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 32.65 67.37 0.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.206 0.527 . . . . 0.0 111.468 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.54 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 63.0 ttt-85 -124.03 -87.55 0.62 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.249 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.54 ' HB2' ' O ' ' A' ' 40' ' ' ARG . . . 168.82 157.34 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.812 0.339 . . . . 0.0 111.772 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.33 -148.71 0.27 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.78 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.434 ' HD3' ' O ' ' B' ' 152' ' ' MET . 0.0 OUTLIER -129.09 178.73 6.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.715 0.293 . . . . 0.0 111.077 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 26.1 m0 -129.93 176.1 8.33 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.165 0.507 . . . . 0.0 112.151 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.456 ' NZ ' ' O ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -80.26 128.06 33.09 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.008 -179.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.5 m -79.08 101.09 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.977 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 33.14 48.89 0.17 Allowed 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 54.85 30.92 14.66 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -95.95 154.32 17.3 Favored 'General case' 0 C--O 1.237 0.412 0 O-C-N 122.174 -0.329 . . . . 0.0 110.766 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.11 61.91 0.05 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.893 0.378 . . . . 0.0 111.245 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.03 -87.87 1.93 Allowed Glycine 0 C--N 1.334 0.447 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.137 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.65 -162.45 0.08 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 122.548 0.339 . . . . 0.0 111.666 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.48 -65.44 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-O 120.718 0.294 . . . . 0.0 111.061 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HB3' ' CE2' ' A' ' 72' ' ' TRP . 0.4 OUTLIER -157.11 -70.87 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.215 179.428 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.705 ' HA ' ' HB2' ' A' ' 72' ' ' TRP . 2.0 t 52.42 46.04 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.562 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 55' ' ' VAL . . . -18.14 125.68 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.366 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -75.46 143.96 42.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.258 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.402 ' HA ' ' OE1' ' B' ' 142' ' ' GLU . 22.6 p90 -58.91 128.02 35.11 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.113 0.482 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 2.9 tp -113.56 -19.18 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.24 97.75 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.916 0.389 . . . . 0.0 110.895 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -66.04 149.25 50.55 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.787 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 70.7 38.39 1.25 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.451 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -118.96 -147.76 8.22 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.622 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.7 m -176.49 -104.36 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.544 0.172 . . . . 0.0 110.667 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 54.59 91.01 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -47.4 -63.32 1.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.277 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -152.41 144.84 24.07 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.858 -1.064 . . . . 0.0 109.729 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -135.41 18.6 3.37 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.334 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.455 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 7.4 m-80 61.58 79.09 0.26 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.858 0.361 . . . . 0.0 110.989 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -144.5 147.14 32.89 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.213 -179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.433 ' O ' HG13 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -99.54 -65.61 0.95 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.334 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.705 ' HB2' ' HA ' ' A' ' 55' ' ' VAL . 26.9 t90 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.852 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 111.542 0.201 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.433 ' HD3' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -174.35 98.12 0.1 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.155 0.502 . . . . 0.0 110.911 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.551 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 27.2 tt0 -98.79 114.23 26.69 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.887 179.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.522 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -77.76 102.33 7.12 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.453 -178.164 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.742 HD11 HG11 ' B' ' 128' ' ' VAL . 1.1 pt -100.79 109.74 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.696 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.71 117.18 29.55 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -175.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.807 HG22 HG22 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -101.16 104.47 16.31 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 173.794 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.862 HG22 ' HG3' ' A' ' 4' ' ' ARG . 44.6 p -70.1 85.12 0.54 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.209 0.528 . . . . 0.0 110.774 -178.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' B' ' 114' ' ' TYR . 1.6 t -82.3 -138.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.064 -178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 4.3 t70 86.03 -5.34 0.8 Allowed 'General case' 0 C--N 1.35 0.624 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.54 -63.13 1.1 Allowed 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.508 -1.223 . . . . 0.0 107.919 177.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.897 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -47.25 -92.44 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -179.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 26.6 t -178.82 40.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 118.903 0.774 . . . . 0.0 111.435 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.872 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.9 -41.5 18.83 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.759 0.824 . . . . 0.0 112.529 179.709 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.647 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.75 -39.55 25.38 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -174.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.669 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -59.49 -50.72 72.83 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.413 1.006 . . . . 0.0 111.944 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.957 HD23 ' CE2' ' B' ' 120' ' ' TYR . 2.1 mt -53.8 -43.57 69.45 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.599 0.714 . . . . 0.0 111.767 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 7.8 pttt -79.19 -32.53 44.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.52 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.482 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -61.93 -26.5 68.22 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.573 -1.194 . . . . 0.0 110.166 178.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.957 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.09 -39.52 14.52 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.881 179.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.67 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 26.2 t0 138.14 49.95 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.729 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -159.96 -37.06 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -179.891 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' B' ' 122' ' ' VAL . 11.9 p30 55.61 -109.61 0.5 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.047 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -144.2 1.38 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.792 ' HA ' HG22 ' A' ' 7' ' ' VAL . 13.3 t -38.82 -64.28 0.45 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.871 -178.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -89.35 -26.88 24.4 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.769 177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.65 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -55.66 -61.84 2.09 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.227 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.047 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.7 t -54.37 -55.49 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 121.312 0.577 . . . . 0.0 110.044 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.709 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 29.1 t -47.14 -47.66 23.49 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.1 -47.07 12.04 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.657 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.612 HG21 HG21 ' A' ' 31' ' ' THR . 2.4 m -56.43 -48.27 77.33 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.695 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.867 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 5.5 mmt -51.62 -48.55 63.25 Favored 'General case' 0 C--O 1.21 -0.997 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.768 179.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -54.58 -36.38 64.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.96 -48.31 46.06 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 1.013 ' HB3' HD21 ' A' ' 17' ' ' LEU . 5.4 tt0 -74.62 -21.7 59.32 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.943 0.402 . . . . 0.0 110.376 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -78.09 -32.98 50.91 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.282 0.633 . . . . 0.0 110.754 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.636 ' CB ' HG11 ' A' ' 55' ' ' VAL . 8.2 mtt85 -81.98 -51.97 7.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.592 0.71 . . . . 0.0 110.655 179.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER -73.95 -21.34 60.06 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 -176.673 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.107 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -30.05 100.16 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.551 ' O ' ' HB2' ' B' ' 141' ' ' ALA . 0.0 OUTLIER 171.7 -80.89 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.33 179.091 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' B' ' 140' ' ' ARG . . . 164.49 -87.53 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.785 0.434 . . . . 0.0 111.035 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 58' ' ' PHE . 2.8 tt0 47.49 90.49 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -77.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.252 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 22.6 m95 47.32 -97.31 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -174.05 109.24 0.14 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.498 0.19 . . . . 0.0 110.826 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.8 p -62.26 150.9 8.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.29 -142.01 0.33 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.074 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -137.5 143.54 41.75 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.826 0.346 . . . . 0.0 110.551 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -81.24 123.46 28.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.827 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.22 141.0 28.97 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.27 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -124.97 122.51 4.71 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.682 -178.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.434 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 26.7 mtp -114.41 163.14 15.74 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.701 0.286 . . . . 0.0 110.83 179.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.592 HG12 ' H ' ' B' ' 154' ' ' GLU . 3.1 t -120.48 167.82 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.91 0.386 . . . . 0.0 111.816 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.592 ' H ' HG12 ' B' ' 153' ' ' VAL . 2.3 mm-40 -106.83 -93.02 0.39 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.396 -178.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.48 HG23 ' CD1' ' B' ' 172' ' ' TRP . 0.0 OUTLIER -108.52 -52.63 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.199 -179.58 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.778 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . . . 41.53 42.73 2.05 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.443 178.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -163.6 109.87 1.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.957 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.86 -51.09 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.189 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.49 HG22 ' N ' ' B' ' 160' ' ' GLU . 3.9 mt -108.82 165.56 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.634 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 161' ' ' MET . 0.0 OUTLIER -90.23 -167.31 1.8 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.87 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . 0.519 ' HB2' ' O ' ' B' ' 160' ' ' GLU . 0.4 OUTLIER 82.46 155.11 0.11 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.361 0.6 . . . . 0.0 111.878 179.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -72.19 104.26 3.59 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.19 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.76 38.74 3.03 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.683 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 53.5 p -169.92 78.47 0.1 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.662 0.268 . . . . 0.0 111.621 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -99.06 -74.78 0.58 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.706 0.289 . . . . 0.0 110.418 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -119.31 -54.95 2.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.345 0.593 . . . . 0.0 110.148 178.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.41 ' CB ' ' HE1' ' B' ' 120' ' ' TYR . 2.1 t0 -153.37 -168.36 2.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 65.79 -158.89 0.27 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.662 -179.602 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.483 ' HB2' ' O ' ' B' ' 168' ' ' GLU . 41.0 m-80 75.34 103.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 -179.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 8.0 tptp -70.33 63.53 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.93 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.82 -167.48 1.34 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.279 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.778 ' HB2' ' HB2' ' B' ' 156' ' ' ALA . 83.3 m95 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.021 -0.99 . . . . 0.0 111.814 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.439 ' C4 ' ' H71' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 O4'-C1'-C2' 106.737 0.579 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.797 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.561 0 C3'-C2'-C1' 100.172 -1.805 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.797 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.693 0 C3'-C2'-C1' 106.377 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.679 ' C6 ' " C2'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C3'-C2'-C1' 101.558 -0.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.532 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.913 0 N19-C1'-C2' 116.17 1.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.712 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.958 0 C1'-O4'-C4' 107.424 -1.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.81 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.495 0 C3'-C2'-C1' 104.796 1.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.853 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 N19-C1'-C2' 115.559 0.85 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.853 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 107.316 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.654 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.991 0 C3'-C2'-C1' 105.145 1.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.654 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 N19-C1'-C2' 113.162 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.462 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 C3'-C2'-C1' 101.467 -0.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . 0.453 ' N7 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C1'-O4'-C4' 110.516 0.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.551 ' H71' " C2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.785 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 101.741 -0.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.892 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.59 0 C3'-C2'-C1' 101.605 -0.782 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.892 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.858 0 C4'-C3'-C2' 104.701 1.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.627 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.044 0 C1'-O4'-C4' 106.512 -2.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.627 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.747 0 O4'-C1'-C2' 107.424 1.203 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.558 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.819 0 C3'-C2'-C1' 105.514 2.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.57 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.669 0 C3'-C2'-C1' 105.221 1.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.57 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 O4'-C1'-C2' 106.954 0.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.485 H2'' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.899 0 C4'-C3'-C2' 104.533 1.333 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.609 " O5'" ' H8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 C3'-C2'-C1' 104.997 1.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.532 ' C4 ' ' C6 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 N19-C1'-C2' 115.593 0.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.532 ' C6 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C4'-C3' 106.185 0.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.457 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 111.107 0.039 . . . . 0.0 111.107 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.669 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -20.9 117.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.769 0.668 . . . . 0.0 112.418 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' B' ' 108' ' ' THR . 59.9 tp60 -100.14 120.33 39.71 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.016 0.436 . . . . 0.0 110.869 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.0 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.3 ttm-85 -79.29 112.44 16.52 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -177.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.784 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -118.2 122.18 68.99 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 176.77 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.753 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -131.54 140.36 49.47 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 118.918 -1.113 . . . . 0.0 112.909 -178.168 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.75 HG23 ' HB ' ' A' ' 9' ' ' VAL . 2.0 m -100.83 107.99 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.65 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.7 OUTLIER -70.42 67.64 0.34 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.622 0.725 . . . . 0.0 109.596 -179.171 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.75 ' HB ' HG23 ' A' ' 7' ' ' VAL . 7.9 p -95.88 -137.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.03 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER 166.15 -82.83 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -178.903 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.618 ' HA ' ' HG2' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -104.8 9.89 34.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.19 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.752 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -80.22 68.33 6.33 Favored 'General case' 0 C--N 1.359 0.98 0 CA-C-N 119.807 1.185 . . . . 0.0 108.706 179.416 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB3' ' N ' ' B' ' 133' ' ' GLN . 2.6 m 61.16 -28.59 0.05 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.682 -1.144 . . . . 0.0 113.736 -179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.724 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -45.91 -60.26 2.35 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-O 121.149 0.5 . . . . 0.0 111.115 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.3 pt20 -48.75 -38.26 21.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.938 -177.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.674 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -59.02 -46.56 87.88 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.771 HD21 ' CB ' ' B' ' 135' ' ' GLU . 0.5 OUTLIER -55.34 -49.69 71.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.474 0.654 . . . . 0.0 110.849 -179.724 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.678 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.3 pttt -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.538 179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.23 -29.39 67.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.337 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.968 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.3 -44.33 10.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.526 178.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.595 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . 0.4 OUTLIER 152.28 27.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.393 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.5 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 76.4 t -160.15 87.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.678 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -53.89 -87.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.576 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.007 HD13 HG23 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -155.22 -1.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 179.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.804 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.3 p -38.91 -64.51 0.44 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-N 118.941 0.791 . . . . 0.0 111.681 -176.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.58 -19.99 57.26 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.774 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.712 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -66.8 -61.66 1.84 Allowed 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 122.766 0.426 . . . . 0.0 110.741 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.935 HG23 ' CG2' ' A' ' 24' ' ' ILE . 10.0 t -50.55 -60.4 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 C-N-CA 120.309 -0.556 . . . . 0.0 109.923 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.864 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 8.8 p -50.1 -41.78 48.98 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.8 m -67.1 -52.47 41.51 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.516 HG22 HD11 ' B' ' 127' ' ' LEU . 49.1 m -61.24 -34.6 75.4 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.836 178.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.931 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -65.88 -58.15 6.25 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.562 179.089 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.464 ' OE1' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.92 -33.99 19.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.718 0.294 . . . . 0.0 110.885 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.41 -50.73 12.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.831 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.78 ' CB ' HD21 ' B' ' 117' ' ' LEU . 1.4 mm-40 -70.83 -19.14 62.69 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.318 177.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.788 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.49 -49.11 8.93 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 123.664 0.786 . . . . 0.0 110.88 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.464 ' HD2' ' OE1' ' A' ' 33' ' ' GLN . 4.7 mtt85 -57.49 -53.7 55.18 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 121.389 0.614 . . . . 0.0 110.886 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -59.21 -45.44 91.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.869 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 24.54 94.26 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.42 144.97 33.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.359 0.599 . . . . 0.0 111.842 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.649 ' HB3' HG11 ' A' ' 46' ' ' VAL . . . -136.31 -80.36 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.097 178.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -69.3 -71.71 0.21 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.301 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp-105 -166.29 -52.17 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.759 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -112.47 -95.4 0.44 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -99.67 118.5 36.33 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.705 0.288 . . . . 0.0 111.242 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.701 HG13 ' H ' ' A' ' 47' ' ' GLU . 1.4 p -128.77 -77.66 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.546 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.701 ' H ' HG13 ' A' ' 46' ' ' VAL . 10.7 tt0 -136.32 135.54 38.97 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.842 0.354 . . . . 0.0 111.574 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -144.37 140.71 29.23 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -115.23 138.01 51.4 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.061 0.458 . . . . 0.0 111.985 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -109.24 132.9 53.68 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.156 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 119.98 -148.67 17.9 Favored Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.127 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.473 ' O ' HG13 ' A' ' 53' ' ' VAL . 0.0 OUTLIER 59.71 83.66 0.13 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.013 0.435 . . . . 0.0 111.736 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 52' ' ' MET . 0.3 OUTLIER -160.1 168.76 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.668 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -64.09 1.02 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.772 ' HA ' ' CE2' ' A' ' 72' ' ' TRP . 12.0 t 70.92 10.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.287 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 46.52 32.14 1.54 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.052 0.453 . . . . 0.0 111.652 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.439 ' HD3' ' HB ' ' A' ' 55' ' ' VAL . 23.9 ptt180 -109.47 -17.04 13.86 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.31 -47.05 5.58 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.59 0.233 . . . . 0.0 111.322 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.727 HD13 ' N ' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -137.53 153.63 28.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.284 -179.84 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.727 ' N ' HD13 ' A' ' 59' ' ' ILE . 3.3 pt-20 -117.19 114.57 23.85 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.126 0.489 . . . . 0.0 111.607 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.664 ' HG2' HD12 ' A' ' 59' ' ' ILE . 0.5 OUTLIER -171.12 123.46 0.59 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.9 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -73.32 -70.82 0.34 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.759 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.452 ' O ' ' HB3' ' A' ' 64' ' ' SER . . . 73.76 162.99 8.37 Favored Glycine 0 C--N 1.337 0.596 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.44 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 98.9 p 174.53 113.98 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.764 0.282 . . . . 0.0 111.522 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -101.72 -70.32 0.75 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.857 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.595 ' HB3' ' HB3' ' A' ' 21' ' ' ASP . . . -162.29 -118.95 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.444 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.473 ' O ' HG21 ' A' ' 22' ' ' VAL . 3.5 m-20 -84.54 80.83 9.1 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.058 0.456 . . . . 0.0 110.848 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -124.73 177.56 5.92 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.035 -179.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.21 136.97 40.2 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.863 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.11 116.65 17.3 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.848 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -93.04 -50.19 5.65 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.913 179.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.772 ' CE2' ' HA ' ' A' ' 55' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.493 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 120.509 0.195 . . . . 0.0 111.384 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.454 ' HD3' ' OP2' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -168.58 163.02 12.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.052 179.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.546 ' HG2' HG22 ' B' ' 105' ' ' ILE . 3.3 tt0 -109.93 110.57 21.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.132 0.492 . . . . 0.0 112.129 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.528 ' HD3' ' H71' ' C' ' 178' ' ' ' DT' . 7.8 ttm105 -78.69 102.38 8.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.777 HD11 HG11 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -99.09 116.09 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.776 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 178.891 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.753 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -115.74 124.5 50.96 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.599 -176.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 1.007 HG23 HD13 ' A' ' 24' ' ' ILE . 1.1 t -100.6 98.7 7.23 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 1.0 HG22 ' HG3' ' A' ' 4' ' ' ARG . 48.4 p -70.16 98.66 1.37 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.97 -0.456 . . . . 0.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.104 HG21 ' CB ' ' B' ' 114' ' ' TYR . 3.0 t -88.98 -129.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.449 ' N ' HG12 ' B' ' 109' ' ' VAL . 22.5 t70 85.47 -9.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 67.3 p -131.5 -61.33 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.824 178.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.881 ' HB2' HG13 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -39.27 -92.54 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.879 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 28.5 t 170.85 39.38 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.731 0.776 . . . . 0.0 110.149 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.104 ' CB ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -84.23 -45.17 13.16 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -179.26 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.7 -34.92 12.87 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.305 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.788 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -60.71 -56.92 15.51 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.678 0.672 . . . . 0.0 111.549 179.677 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.931 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 2.9 mt -47.16 -48.85 23.36 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.069 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -77.04 -26.21 53.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.643 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.82 -30.4 71.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.699 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.887 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.16 -41.41 13.02 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.789 178.408 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.563 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 152.95 26.17 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.029 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.777 ' CG1' HD22 ' B' ' 117' ' ' LEU . 0.6 OUTLIER -135.29 80.1 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -179.001 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.03 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.69 53.74 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.652 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER 42.35 -9.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 118.701 2.852 . . . . 0.0 118.701 178.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.565 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -38.25 -63.15 0.51 Allowed 'General case' 0 C--O 1.244 0.773 0 CA-C-N 119.601 1.091 . . . . 0.0 110.946 -176.966 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.49 -26.78 34.72 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.693 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.59 ' CD1' ' CD1' ' B' ' 117' ' ' LEU . 0.3 OUTLIER -59.4 -61.51 2.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.628 0.371 . . . . 0.0 110.436 179.332 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.968 HG23 ' CG2' ' B' ' 124' ' ' ILE . 4.0 t -47.74 -64.31 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.752 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.05 -34.8 10.06 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 178.574 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 98.8 m -72.44 -52.8 14.32 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -42.55 99.14 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.424 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.728 ' HE2' ' CG2' ' A' ' 24' ' ' ILE . 6.7 mmt -52.31 -51.17 60.13 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.674 179.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.498 ' N ' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -55.92 -36.91 68.25 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.702 0.287 . . . . 0.0 111.079 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.4 -52.51 26.25 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.771 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.2 mp0 -70.77 -19.21 62.73 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.61 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.708 ' O ' HD11 ' B' ' 139' ' ' LEU . . . -87.45 -28.82 21.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 122.776 0.43 . . . . 0.0 111.243 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -54.07 6.39 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 121.652 0.739 . . . . 0.0 109.871 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.562 ' HB3' ' HB2' ' B' ' 141' ' ' ALA . 3.9 mmp_? -83.42 -37.87 22.66 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.12 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.968 HD23 ' CD2' ' A' ' 20' ' ' TYR . 2.2 mp 48.23 -85.01 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.645 0.778 . . . . 0.0 112.1 -178.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.41 -59.39 2.55 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.456 0.169 . . . . 0.0 111.342 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' B' ' 138' ' ' ARG . . . 57.54 -159.75 0.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -123.34 163.8 20.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.955 0.407 . . . . 0.0 111.31 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.94 59.76 3.9 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.023 0.439 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -87.11 -40.91 14.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.144 -179.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -74.85 86.84 2.25 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 120.987 0.422 . . . . 0.0 111.821 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.465 HG12 ' HG2' ' B' ' 147' ' ' GLU . 25.8 t -81.29 134.73 26.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.465 ' HG2' HG12 ' B' ' 146' ' ' VAL . 2.0 mm-40 65.85 98.67 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.423 0.63 . . . . 0.0 111.612 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' B' ' 149' ' ' GLN . 16.3 t30 -102.76 -145.33 0.36 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.676 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' B' ' 148' ' ' ASN . 33.6 mt-30 73.12 -55.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.438 0.295 . . . . 0.0 111.379 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.41 130.59 44.35 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 110.716 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -115.91 9.61 18.57 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.871 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -116.83 86.44 2.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.339 0.569 . . . . 0.0 111.105 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.451 HG13 ' N ' ' B' ' 154' ' ' GLU . 8.9 p -117.04 -46.63 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.46 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.451 ' N ' HG13 ' B' ' 153' ' ' VAL . 1.0 OUTLIER -134.04 -58.31 0.85 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 111.136 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.577 ' HA ' ' CE2' ' B' ' 172' ' ' TRP . 16.4 t 76.45 3.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 176.33 150.95 0.14 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.892 0.377 . . . . 0.0 111.529 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' B' ' 157' ' ' ARG . 8.7 tpt180 -175.19 -50.87 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.618 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.401 ' HD1' ' HA ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -103.05 163.12 12.41 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.848 179.165 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.546 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 1.8 pp -35.72 142.56 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.37 -179.21 0.44 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.883 -179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.77 -65.07 0.5 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.481 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -103.44 -59.8 1.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.581 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 137.26 -87.18 0.23 Allowed Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.547 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.1 84.03 1.39 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -106.78 178.03 4.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -44.26 -63.6 0.85 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.01 0.433 . . . . 0.0 111.162 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.581 ' HB3' ' CE1' ' B' ' 120' ' ' TYR . 12.6 t70 -165.16 105.27 0.77 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.936 179.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.13 111.58 0.1 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.676 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -151.85 165.94 32.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.06 0.457 . . . . 0.0 111.879 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.546 ' NZ ' ' O ' ' B' ' 159' ' ' ILE . 2.6 pttt -87.96 152.84 21.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.945 178.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.84 145.15 56.34 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.603 0.24 . . . . 0.0 110.432 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.577 ' CE2' ' HA ' ' B' ' 155' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.301 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.641 " H2'" ' H72' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C1'-O4'-C4' 110.624 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.641 ' H72' " H2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C1'-O4'-C4' 110.485 0.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C3'-C2'-C1' 104.124 1.017 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.65 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.918 0 C4'-C3'-C2' 104.661 1.461 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.603 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C4'-C3'-C2' 104.729 1.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.603 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.411 -0.672 0 C4'-C3'-C2' 104.491 1.291 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.664 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.535 0 C3'-C2'-C1' 104.487 1.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.664 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.74 0 O4'-C1'-C2' 104.998 -1.002 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.498 ' H8 ' " O5'" ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 O4'-C1'-C2' 107.138 0.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.496 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.524 0.647 0 C3'-C2'-C1' 105.801 2.215 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.593 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 O4'-C1'-C2' 106.848 0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.593 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 101.81 -0.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-C2' 106.908 0.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 107.027 0.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.524 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C4'-C3'-C2' 102.419 -0.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.524 ' C8 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.605 0 C1'-O4'-C4' 110.393 0.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.899 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.698 0 C4'-C3'-C2' 101.343 -1.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.899 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C4'-C3'-C2' 104.26 1.06 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.658 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C5'-C4'-O4' 108.741 -0.412 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.56 " H2'" ' H71' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 104.928 1.592 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.56 ' H71' " H2'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.718 0 C4'-C3'-C2' 104.796 1.596 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.413 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-C2' 107.101 0.91 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.413 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C1'-O4'-C4' 107.045 -1.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.455 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 C4'-C3'-C2' 104.312 1.112 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 O4'-C1'-C2' 104.836 -1.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C1'-O4'-C4' 110.279 0.413 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -163.08 122.34 2.15 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.93 0.395 . . . . 0.0 110.981 179.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.735 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 36.7 tp60 -109.66 117.51 34.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.232 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.932 ' HG3' HG22 ' B' ' 108' ' ' THR . 3.5 ttm180 -78.51 106.12 10.25 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 121.67 0.748 . . . . 0.0 112.221 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.969 HD13 ' CD1' ' B' ' 114' ' ' TYR . 7.0 pt -110.41 128.1 66.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 177.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.731 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.03 131.6 42.62 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 118.461 -1.295 . . . . 0.0 113.822 -177.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.95 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.48 105.39 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.604 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 7.4 p -70.55 91.68 0.8 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.281 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.022 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -88.58 -147.52 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.805 -178.908 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.589 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 28.4 t70 120.49 -0.28 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.327 1.051 . . . . 0.0 108.511 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.9 p -158.03 -33.12 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.079 -0.964 . . . . 0.0 112.694 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.743 ' HB2' HG13 ' A' ' 9' ' ' VAL . 2.3 m-20 -75.05 19.9 0.14 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -176.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.579 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 32.5 m 81.38 8.23 1.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 175.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.022 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -63.25 -45.77 90.01 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.504 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 7.4 mt-30 -49.62 -41.24 41.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -176.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.606 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -59.53 -48.46 81.56 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -179.26 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.006 HD21 ' HB3' ' B' ' 135' ' ' GLU . 0.4 OUTLIER -50.34 -56.91 9.3 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.525 0.679 . . . . 0.0 111.498 -179.555 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.636 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 pttt -70.4 -25.83 63.41 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.113 179.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -65.71 -27.03 68.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.325 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.953 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.11 -38.69 15.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 118.316 -0.85 . . . . 0.0 110.264 178.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 1.3 m-20 148.98 33.84 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.0 t -151.08 88.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 121.821 -0.55 . . . . 0.0 112.429 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.037 ' O ' HD12 ' A' ' 24' ' ' ILE . 63.4 m-80 -70.04 60.82 0.18 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.3 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.037 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 40.65 -11.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 118.539 2.792 . . . . 0.0 118.539 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -38.1 -62.05 0.6 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.773 1.17 . . . . 0.0 110.787 -177.619 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.02 -30.97 40.59 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.231 177.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.537 ' HB3' HG22 ' A' ' 24' ' ' ILE . 2.8 tp -60.27 -61.68 2.42 Favored 'General case' 0 C--N 1.338 0.074 0 O-C-N 122.916 -0.167 . . . . 0.0 111.001 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.084 HG22 ' CG2' ' B' ' 128' ' ' VAL . 37.2 t -45.66 -66.31 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.063 0.459 . . . . 0.0 110.986 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.764 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 15.3 p -49.39 -44.08 44.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.408 ' O ' ' HG2' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -72.72 -44.85 61.19 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.177 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 m -54.42 -38.16 65.93 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.559 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.825 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 5.5 mmt -56.34 -57.38 12.52 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.58 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 30' ' ' THR . 4.5 pt20 -50.44 -38.63 44.45 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.74 0.305 . . . . 0.0 111.317 -179.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -69.88 -51.67 31.23 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.431 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.689 ' HB3' HD21 ' B' ' 117' ' ' LEU . 4.5 tp10 -68.72 -23.11 64.32 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.273 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.782 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -79.31 -46.02 18.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 122.572 0.349 . . . . 0.0 110.689 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.27 -50.8 68.71 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-O 121.913 0.863 . . . . 0.0 109.971 178.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.702 ' HD3' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -83.76 -49.93 8.62 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.392 -1.731 . . . . 0.0 113.486 -177.2 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.266 HD11 ' CE2' ' B' ' 120' ' ' TYR . 62.7 mt 48.58 93.18 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.467 0.707 . . . . 0.0 111.865 -178.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.583 ' HA ' ' O ' ' B' ' 168' ' ' GLU . 0.0 OUTLIER 81.9 -108.57 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.507 179.573 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.702 ' HB3' ' HD3' ' A' ' 38' ' ' ARG . . . 67.68 127.01 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.219 0.533 . . . . 0.0 112.01 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.01 80.96 8.99 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.533 ' HG3' ' HB2' ' B' ' 147' ' ' GLU . 0.0 OUTLIER -175.47 120.35 0.19 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.219 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -127.1 -156.14 0.73 Allowed 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.91 -179.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.52 ' NZ ' ' O ' ' B' ' 153' ' ' VAL . 0.0 OUTLIER -76.15 166.85 22.87 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.519 0.676 . . . . 0.0 112.472 -179.036 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.9 p -167.45 127.58 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.485 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -107.67 103.02 12.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.058 0.456 . . . . 0.0 111.349 -179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -148.15 35.93 0.83 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.197 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -139.89 120.16 13.87 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 120.787 0.327 . . . . 0.0 111.612 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -93.53 152.79 18.82 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.701 179.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -167.4 -120.64 0.53 Allowed Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.795 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.2 ptp 179.42 -47.89 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.575 0.226 . . . . 0.0 111.541 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.745 HG23 ' CG2' ' A' ' 55' ' ' VAL . 3.0 m -109.32 160.69 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-O 120.793 0.33 . . . . 0.0 111.815 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 72' ' ' TRP . 67.8 mm-40 -53.05 -65.15 0.61 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.249 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.745 ' CG2' HG23 ' A' ' 53' ' ' VAL . 4.0 t 60.08 10.04 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.411 ' O ' ' HD2' ' B' ' 143' ' ' ARG . . . 41.63 41.16 1.6 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.158 0.504 . . . . 0.0 111.296 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -128.44 95.85 4.26 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.554 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -161.32 173.95 14.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.617 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.6 pt -109.58 -100.45 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.15 -165.01 0.2 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.554 0.216 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.0 ttp -100.04 41.82 1.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.649 0.261 . . . . 0.0 111.504 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.539 ' HB2' ' HB2' ' B' ' 145' ' ' LYS . 1.0 OUTLIER 69.84 -57.88 0.54 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.924 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.31 176.91 51.6 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 121.15 -0.547 . . . . 0.0 112.116 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -102.58 -89.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.548 0.174 . . . . 0.0 110.653 179.721 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.546 ' HB3' ' O ' ' A' ' 64' ' ' SER . 4.7 p90 172.18 171.47 0.11 Allowed 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.975 0.417 . . . . 0.0 111.098 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.78 -84.25 0.42 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.953 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -161.79 -75.91 0.05 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.205 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.79 -29.38 13.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.507 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -37.13 113.9 0.28 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.379 0.672 . . . . 0.0 112.493 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.9 110.98 0.17 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.118 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -139.45 -61.86 0.54 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.598 ' HB3' ' HB2' ' A' ' 54' ' ' GLU . 2.0 t90 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.112 -0.946 . . . . 0.0 110.995 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 120.212 0.053 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.581 ' HG3' ' C7 ' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -34.39 122.83 0.51 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 8' ' ' THR . 7.6 tt0 -100.34 113.28 25.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.591 178.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.5 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 4.5 ttm180 -78.38 101.11 7.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.218 0.532 . . . . 0.0 110.607 -179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.748 HG12 HG13 ' A' ' 7' ' ' VAL . 0.6 OUTLIER -99.36 118.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.41 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.731 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -123.22 123.21 40.26 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -176.152 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.78 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.45 103.33 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 175.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.932 HG22 ' HG3' ' A' ' 4' ' ' ARG . 64.9 p -70.06 67.9 0.3 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.652 0.739 . . . . 0.0 109.751 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.035 HG11 ' CB ' ' B' ' 114' ' ' TYR . 8.0 p -70.31 -130.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 114.13 -1.396 . . . . 0.0 111.831 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.736 ' H ' HG22 ' B' ' 109' ' ' VAL . 25.9 t70 84.89 -5.38 0.95 Allowed 'General case' 0 N--CA 1.485 1.292 0 CA-C-N 119.893 1.224 . . . . 0.0 109.603 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.29 -64.54 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.642 177.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.764 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.81 -84.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.265 -179.816 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.96 44.29 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.132 0.491 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.035 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.35 -44.83 14.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.566 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.6 mp0 -48.85 -38.95 23.85 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -175.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.782 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.17 -56.72 9.84 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.727 0.694 . . . . 0.0 111.761 179.516 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.772 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.9 OUTLIER -58.33 -48.51 80.31 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.034 -179.005 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -73.41 -26.33 60.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.287 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.91 -25.25 42.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.874 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.266 ' CE2' HD11 ' A' ' 39' ' ' LEU . 1.4 m-30 -87.97 -51.72 5.66 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.6 m-20 144.45 48.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 O-C-N 124.36 1.038 . . . . 0.0 112.096 177.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.772 ' CG1' HD12 ' B' ' 117' ' ' LEU . 5.3 p -150.69 85.76 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.017 ' O ' HD12 ' B' ' 124' ' ' ILE . 43.1 m-80 -68.3 59.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.734 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.017 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.8 OUTLIER 37.42 1.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 178.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.09 -62.35 0.57 Allowed 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.584 1.083 . . . . 0.0 110.373 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' B' ' 130' ' ' THR . . . -83.33 -31.87 26.87 Favored Glycine 0 C--O 1.223 -0.574 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.169 178.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.769 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.66 -62.02 2.02 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.795 0.438 . . . . 0.0 111.888 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.084 ' CG2' HG22 ' A' ' 28' ' ' VAL . 1.8 t -52.34 -64.7 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.145 0.497 . . . . 0.0 110.929 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.731 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 84.6 p -50.46 -41.63 53.21 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.816 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.425 ' CB ' ' O ' ' B' ' 126' ' ' GLY . 7.6 m -65.7 -51.88 55.8 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.1 -38.52 62.65 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.879 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.889 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 7.2 mtt -58.11 -55.52 33.83 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.974 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.579 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -50.57 -39.98 51.04 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 118.21 0.459 . . . . 0.0 111.115 179.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -68.79 -52.54 29.19 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.663 0.268 . . . . 0.0 110.754 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 1.006 ' HB3' HD21 ' A' ' 17' ' ' LEU . 22.6 tp10 -68.76 -22.03 64.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.208 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.606 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -80.08 -46.77 15.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.424 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -53.31 59.09 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 121.581 0.705 . . . . 0.0 110.325 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.718 ' HG2' ' HB3' ' B' ' 141' ' ' ALA . 0.5 OUTLIER -71.59 -51.74 21.78 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.166 -178.888 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.953 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 37.15 33.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -179.75 59.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.718 ' HB3' ' HG2' ' B' ' 138' ' ' ARG . . . -168.51 130.28 1.33 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.52 129.0 1.53 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.682 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -166.43 -82.15 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.559 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.42 ' O ' ' HA ' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -145.85 176.58 9.57 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.907 0.384 . . . . 0.0 111.774 -179.48 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -115.72 -89.56 0.56 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.025 -178.929 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.4 m 41.86 68.43 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.533 ' HB2' ' HG3' ' A' ' 43' ' ' ARG . 1.4 pm0 -84.59 141.95 30.31 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.693 178.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -112.47 -85.19 0.58 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' B' ' 150' ' ' GLU . 10.8 tt0 -160.23 107.59 1.61 Allowed 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.443 0.164 . . . . 0.0 111.443 -179.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' B' ' 149' ' ' GLN . 0.7 OUTLIER 176.27 148.61 0.11 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.502 179.683 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -177.05 146.86 8.02 Favored Glycine 0 C--N 1.335 0.504 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.118 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.417 ' O ' ' HG3' ' B' ' 154' ' ' GLU . 1.1 ttp 178.89 -34.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.52 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 90.6 t -68.12 95.96 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.575 0 CA-C-O 121.005 0.431 . . . . 0.0 111.891 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' B' ' 152' ' ' MET . 0.5 OUTLIER -141.06 179.14 6.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.89 179.68 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.501 ' CG2' ' CZ2' ' B' ' 172' ' ' TRP . 0.8 OUTLIER -151.94 -42.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.318 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 62.94 84.58 0.14 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.229 0.538 . . . . 0.0 111.347 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -135.39 32.21 3.11 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 -176.71 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.739 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 6.6 mt -131.88 120.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.73 0.3 . . . . 0.0 111.352 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.29 91.52 0.74 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.294 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 19.8 tpp -96.85 59.65 1.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.987 0.422 . . . . 0.0 111.141 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -176.96 -163.8 0.09 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.747 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 165.72 -61.89 0.23 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.482 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 2.2 m -58.17 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.602 ' CG ' HG23 ' B' ' 122' ' ' VAL . 1.0 OUTLIER -147.89 166.91 26.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.784 179.612 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.678 ' CB ' ' HB2' ' B' ' 120' ' ' TYR . . . -51.24 -88.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.905 ' HB2' HD22 ' A' ' 39' ' ' LEU . 4.3 m-20 -125.82 -74.13 0.61 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.812 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.583 ' O ' ' HA ' ' A' ' 40' ' ' ARG . 0.6 OUTLIER 35.16 -134.4 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.436 0.46 . . . . 0.0 112.095 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' B' ' 168' ' ' GLU . 4.9 m120 65.69 167.14 0.19 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.173 0.442 . . . . 0.0 110.814 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.39 -86.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -158.79 -66.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.696 0.284 . . . . 0.0 111.193 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.501 ' CZ2' ' CG2' ' B' ' 155' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.567 -0.73 . . . . 0.0 109.996 179.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.741 " H1'" " O4'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C3'-C2'-C1' 104.923 1.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.741 " O4'" " H1'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 P-O3'-C3' 120.881 0.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.558 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 C3'-C2'-C1' 104.66 1.4 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.604 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C4'-C3'-C2' 104.652 1.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.652 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 C4'-C3'-C2' 104.723 1.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.669 ' H72' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C4'-C3'-C2' 104.583 1.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.456 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 104.552 1.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.589 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.752 0 O4'-C1'-C2' 104.761 -1.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.589 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.496 0 O4'-C1'-C2' 107.216 1.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.649 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.737 0 C3'-C2'-C1' 105.611 2.08 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.649 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 O4'-C1'-C2' 107.033 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.585 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C4'-C3'-C2' 103.974 0.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O4'-C1'-C2' 107.063 0.875 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-C2' 107.005 0.822 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.942 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C5'-C4'-C3' 115.643 0.629 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.942 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 C4'-C3'-C2' 103.964 0.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.475 " O5'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.52 0 O4'-C1'-C2' 106.921 0.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.488 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -0.966 0 C1'-O4'-C4' 106.792 -2.077 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.647 H2'' " O5'" ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.902 0 C1'-O4'-C4' 107.449 -1.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.647 " O5'" H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 C3'-C2'-C1' 106.49 2.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.565 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 105.191 1.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 O4'-C1'-C2' 107.254 1.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.532 H2'' " O5'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.022 0 C1'-O4'-C4' 107.655 -1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.532 " O5'" H2'' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.612 0 O4'-C1'-C2' 106.901 0.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.502 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.711 0 N19-C1'-C2' 115.444 0.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 102.096 -0.431 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.2 ptp . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 120.65 0.262 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.5 mttp 55.74 68.72 0.82 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.919 0.39 . . . . 0.0 111.554 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.604 ' HG2' ' CE2' ' B' ' 114' ' ' TYR . 5.0 tp60 -69.58 115.15 8.49 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.138 0.494 . . . . 0.0 110.211 178.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.4 OUTLIER -78.1 99.23 6.07 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.778 0.799 . . . . 0.0 109.072 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.818 HD11 HG11 ' A' ' 28' ' ' VAL . 1.9 pt -99.34 120.22 48.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 107.022 -1.474 . . . . 0.0 107.022 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.675 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.66 126.21 34.07 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 118.755 -1.178 . . . . 0.0 114.129 -176.661 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.486 ' O ' HG22 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -99.45 109.47 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 175.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.632 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 1.6 p -70.67 94.77 1.04 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.865 HG21 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -99.59 -120.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 118.137 -0.935 . . . . 0.0 112.368 -177.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB2' ' N ' ' B' ' 103' ' ' GLN . 4.7 t70 97.32 11.85 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 CA-C-O 122.088 0.946 . . . . 0.0 109.144 -175.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -170.69 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.386 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.748 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 0.0 OUTLIER -68.74 49.97 0.07 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -176.491 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.677 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.6 OUTLIER 52.26 12.59 0.23 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.448 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.876 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -67.17 -57.4 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.535 0.683 . . . . 0.0 112.159 -179.433 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.808 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 6.6 mt-30 -50.29 -28.71 8.27 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -62.76 -57.17 11.87 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.416 0.553 . . . . 0.0 111.655 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.977 HD23 ' CE2' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -47.26 -48.56 24.54 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.89 0.852 . . . . 0.0 111.9 -179.187 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.71 ' CB ' ' HA ' ' A' ' 23' ' ' ASN . 3.5 pttt -79.27 -26.41 42.36 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.682 -178.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -69.7 -22.96 63.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.005 179.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.056 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.01 -41.24 13.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.871 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 167.12 -12.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 177.045 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.594 ' O ' ' N ' ' A' ' 24' ' ' ILE . 75.2 t -109.6 80.76 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-O 120.539 0.209 . . . . 0.0 111.206 -178.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.074 ' C ' HD12 ' A' ' 24' ' ' ILE . 61.6 m-80 -63.4 60.69 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.185 0.517 . . . . 0.0 111.036 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.074 HD12 ' C ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER 46.01 -21.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 178.597 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.765 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.28 -63.8 0.47 Allowed 'General case' 0 C--O 1.245 0.862 0 CA-C-N 118.534 0.606 . . . . 0.0 112.21 -173.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.04 -14.26 72.58 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.29 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.779 HD12 HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -65.97 -61.26 2.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 122.343 0.257 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.966 HG23 HG22 ' A' ' 24' ' ' ILE . 55.7 t -51.09 -59.21 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.693 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 25.7 p -49.35 -36.81 22.58 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.532 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -74.31 -56.08 5.29 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.491 HG23 HD21 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -56.05 -44.37 78.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.696 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.862 ' HE2' HG23 ' B' ' 124' ' ' ILE . 6.6 mmt -52.57 -46.12 66.75 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.707 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.455 ' N ' ' HB3' ' B' ' 113' ' ' SER . 0.0 OUTLIER -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.831 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -60.49 -51.81 67.87 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.684 ' HG3' HD11 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -63.45 -34.08 76.97 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.503 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.678 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -67.17 -45.39 77.12 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.999 0.428 . . . . 0.0 109.906 177.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -53.56 56.68 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.61 0.719 . . . . 0.0 109.986 178.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -68.23 -53.41 24.88 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.123 -178.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.876 ' CD2' ' HB1' ' B' ' 166' ' ' ALA . 0.6 OUTLIER 24.23 69.83 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.966 0.907 . . . . 0.0 112.713 179.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -168.3 -75.76 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.134 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.29 -176.7 2.97 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.596 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.491 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -113.48 -74.97 0.61 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.86 131.52 44.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.296 0.57 . . . . 0.0 112.409 -179.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.41 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -138.92 75.01 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.326 179.297 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 44' ' ' TRP . 5.4 ptpt 48.64 58.73 4.95 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.582 -178.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 44' ' ' TRP . 3.0 t -138.33 72.36 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.084 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -100.37 -53.65 3.06 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.563 0.221 . . . . 0.0 110.979 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -147.95 120.83 8.73 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.777 0.322 . . . . 0.0 111.56 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -145.68 -76.17 0.21 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.244 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 63.67 102.84 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.351 0.596 . . . . 0.0 112.498 178.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.54 103.56 1.21 Allowed Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.556 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.7 ptm -110.31 72.2 0.78 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.174 0.511 . . . . 0.0 111.29 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 p -132.95 80.38 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.485 0.66 . . . . 0.0 110.282 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HA ' ' CE3' ' A' ' 72' ' ' TRP . 0.0 OUTLIER -108.68 101.35 10.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.723 -178.438 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.35 64.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.831 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.634 ' HB2' ' HE1' ' A' ' 72' ' ' TRP . . . -139.86 165.93 25.98 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.135 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 18.4 mmt180 -160.82 -177.89 6.46 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.711 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.514 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 90.3 m-85 75.62 106.44 0.08 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.857 0.463 . . . . 0.0 111.559 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.9 mt 66.61 82.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.214 0.53 . . . . 0.0 111.057 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -65.76 98.23 0.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.837 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 14.1 mmm -113.1 173.29 6.46 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 111.841 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -66.44 65.38 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.196 -179.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.29 -84.26 0.52 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.908 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 65' ' ' PHE . 89.9 p -155.2 -88.31 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.477 0.18 . . . . 0.0 111.353 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.419 ' N ' ' OG ' ' A' ' 64' ' ' SER . 0.4 OUTLIER -142.8 -60.95 0.43 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.247 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -160.67 -121.69 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.621 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -95.88 100.69 12.35 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.959 0.409 . . . . 0.0 111.8 -179.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -151.65 29.68 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.825 179.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 28.99 66.47 0.1 Allowed 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -90.65 71.49 6.77 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.173 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.78 -175.84 6.0 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.005 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.634 ' HE1' ' HB2' ' A' ' 56' ' ' ALA . 23.8 m-90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.237 -179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.418 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 2.9 mpp? . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.465 ' HD3' " H3'" ' C' ' 175' ' ' ' DA' . 0.0 OUTLIER -136.37 135.84 39.13 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.736 0.303 . . . . 0.0 110.503 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.644 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 14.4 tt0 -125.93 120.16 29.67 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.568 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 7.6 ttm-85 -79.69 116.6 19.97 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.197 -178.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.901 HD13 HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -113.36 129.77 68.53 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.976 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 176.424 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.716 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -129.12 131.7 47.27 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.262 -0.975 . . . . 0.0 112.461 -178.395 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.765 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.96 91.14 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 23.8 p -69.13 67.54 0.17 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 122.258 1.027 . . . . 0.0 109.735 -178.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.73 HG12 HG12 ' B' ' 107' ' ' VAL . 15.0 p -99.72 -129.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 113.717 -1.583 . . . . 0.0 110.623 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.701 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER 161.52 -84.84 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.008 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.453 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 45.2 t -102.8 11.25 37.81 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.815 -0.612 . . . . 0.0 112.486 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 3.1 t0 -79.24 61.32 3.31 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-N 119.785 1.175 . . . . 0.0 108.105 179.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' ' 29' ' ' SER . 66.0 m 63.33 -22.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.995 -1.002 . . . . 0.0 113.146 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.797 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -47.02 -59.53 3.06 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-O 121.14 0.495 . . . . 0.0 110.852 179.399 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.649 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 2.8 pt20 -48.49 -38.86 21.23 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.927 -177.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.678 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -55.98 -41.38 74.71 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.343 0.52 . . . . 0.0 112.051 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.849 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -64.62 -45.97 84.62 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.006 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.797 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -74.55 -26.05 59.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 178.782 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -65.46 -34.27 77.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.953 -1.022 . . . . 0.0 110.531 178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.707 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -88.21 -26.87 22.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.947 -0.549 . . . . 0.0 110.661 179.134 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.586 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 31.1 t70 124.76 61.32 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 121' ' ' ASP . 24.2 t -156.0 -47.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.536 ' CG ' ' HB3' ' B' ' 118' ' ' LYS . 12.8 m-80 68.69 -112.55 0.11 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 -176.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.982 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -150.02 1.69 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 177.725 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.421 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.89 -63.44 0.59 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.798 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.37 -30.04 20.39 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.071 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.786 HD22 ' HG ' ' B' ' 117' ' ' LEU . 10.5 tp -56.51 -61.6 2.3 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.624 0.212 . . . . 0.0 110.441 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.982 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.3 t -48.76 -60.12 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.748 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 2.2 t -49.0 -46.56 44.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.89 -51.51 39.39 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 23.5 m -59.6 -36.02 75.46 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.584 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.958 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 1.9 mmt -62.9 -57.9 9.23 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.219 -179.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 1.0 OUTLIER -54.49 -33.46 59.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.512 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.04 -52.35 11.28 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HB3' HD21 ' A' ' 17' ' ' LEU . 78.7 mm-40 -71.25 -20.99 62.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.012 0.434 . . . . 0.0 110.363 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.05 -31.88 34.28 Favored 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 123.122 0.569 . . . . 0.0 110.84 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -80.28 -52.55 7.58 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.58 0.705 . . . . 0.0 110.68 179.535 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 -78.72 -36.62 43.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 114.489 -1.232 . . . . 0.0 112.704 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.056 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 31.61 41.52 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.744 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER 162.26 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.061 0.544 . . . . 0.0 110.646 179.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -143.02 151.27 40.65 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.898 0.38 . . . . 0.0 111.811 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.97 -145.56 0.39 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.186 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -150.15 55.04 0.93 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 120.974 0.416 . . . . 0.0 111.523 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -74.49 63.35 1.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.276 0.56 . . . . 0.0 111.41 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.95 129.18 27.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.139 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.564 ' O ' HG13 ' B' ' 146' ' ' VAL . 8.0 p -151.91 89.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.27 0.557 . . . . 0.0 111.958 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' B' ' 148' ' ' ASN . 15.7 mt-10 -141.0 -113.8 0.13 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' B' ' 147' ' ' GLU . 0.3 OUTLIER 77.0 122.25 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.289 0.566 . . . . 0.0 111.808 179.304 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.08 -55.44 0.15 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.773 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -90.72 174.72 7.33 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.789 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -112.05 -57.53 0.45 Allowed Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.918 -0.658 . . . . 0.0 113.036 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.57 149.52 46.14 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.938 0.399 . . . . 0.0 111.383 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.501 HG22 ' O ' ' B' ' 153' ' ' VAL . 14.4 p -167.7 47.54 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.301 0.572 . . . . 0.0 111.649 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -107.45 165.93 11.03 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.457 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 14.0 m -130.01 30.59 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.553 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -85.0 125.82 33.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.243 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.5 90.3 3.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.893 0.378 . . . . 0.0 111.222 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.4 t80 60.38 66.76 0.91 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.838 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.3 pp -145.15 34.98 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.479 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.54 -177.85 0.17 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.3 ttt -168.72 106.9 0.45 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -136.95 158.08 45.28 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.236 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 131.7 -145.14 16.84 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.612 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.3 -172.18 4.11 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.771 0.32 . . . . 0.0 111.236 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.426 ' O ' ' HB3' ' B' ' 166' ' ' ALA . 30.2 m-85 -118.92 145.51 45.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.434 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.876 ' HB1' ' CD2' ' A' ' 39' ' ' LEU . . . 72.17 9.56 5.96 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -131.61 -77.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.929 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -115.19 50.6 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.228 0.537 . . . . 0.0 110.449 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.34 -29.45 63.82 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.38 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 1.1 pttm 34.75 42.05 0.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.433 ' HB3' ' CE3' ' B' ' 172' ' ' TRP . 93.2 m-20 67.47 -60.43 0.38 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.928 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.433 ' CE3' ' HB3' ' B' ' 171' ' ' ASP . 27.1 p90 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.92 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.862 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 111.075 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.862 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.831 0 P-O3'-C3' 120.739 0.866 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.777 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.484 0 C3'-C2'-C1' 104.814 1.51 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.632 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.411 -0.714 0 C3'-C2'-C1' 105.43 1.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.512 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.783 0 C4'-C3'-C2' 104.79 1.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.538 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C4'-C3'-C2' 104.206 1.006 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.51 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 104.862 1.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.517 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C4'-C3'-C2' 104.037 0.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.517 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.183 0.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.509 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C3'-C2'-C1' 105.689 2.135 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.591 H2'' ' C5 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 C3'-C2'-C1' 104.125 1.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.591 ' C5 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C1'-O4'-C4' 110.81 0.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . 0.413 ' C8 ' H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 C5'-C4'-O4' 108.712 -0.43 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 N19-C1'-C2' 115.15 0.594 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.874 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.544 0 O4'-C1'-C2' 106.696 0.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.874 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.434 -0.392 0 C4'-C3'-C2' 104.182 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C4'-C3' 106.211 0.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.559 " H2'" ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.926 0 C3'-C2'-C1' 104.927 1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.559 ' H72' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C3'-C2'-C1' 104.53 1.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.487 " H2'" ' H71' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.714 0 C4'-C3'-C2' 105.061 1.861 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.568 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.412 -0.604 0 C3'-C2'-C1' 106.151 2.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 O4'-C1'-C2' 107.265 1.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.476 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -1.021 0 C1'-O4'-C4' 107.341 -1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.583 ' C8 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 C1'-O4'-C4' 110.634 0.667 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.583 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 103.824 0.624 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.43 ' C6 ' ' N3 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 101.966 -0.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 111.525 0.195 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.563 ' HE3' ' HA ' ' B' ' 109' ' ' VAL . 1.7 mmmt 65.31 -158.82 0.28 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.844 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 2.8 tp60 -135.79 138.6 42.77 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.186 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.953 ' HG3' HG22 ' B' ' 108' ' ' THR . 8.1 ttm-85 -81.6 98.07 8.17 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.648 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.686 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -97.65 109.62 23.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.753 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.677 ' HA ' ' HA ' ' B' ' 106' ' ' THR . 0.4 OUTLIER -116.95 121.59 41.86 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.921 -177.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.883 HG23 HD13 ' B' ' 124' ' ' ILE . 0.8 OUTLIER -98.96 102.55 13.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 176.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.58 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 5.9 p -70.15 67.38 0.3 Allowed 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.941 HG13 ' H ' ' A' ' 10' ' ' ASP . 13.4 p -97.95 -101.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.941 ' H ' HG13 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 70.91 -61.68 0.47 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 104.195 -2.52 . . . . 0.0 104.195 -174.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.561 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -36.58 -70.22 0.1 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 112.83 -1.987 . . . . 0.0 108.804 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.79 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 2.3 m-20 -63.62 -61.54 2.25 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 -175.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 171.7 37.31 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 120.186 1.357 . . . . 0.0 113.347 -179.328 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.925 ' CE1' HD13 ' B' ' 105' ' ' ILE . 1.2 t80 -81.32 -50.5 9.43 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.611 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.1 mm-40 -49.88 -30.12 9.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -176.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.705 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.8 mt -55.5 -59.06 5.36 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.074 0.397 . . . . 0.0 111.306 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.767 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -55.17 -51.26 67.09 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.538 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -72.25 -25.95 61.82 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.234 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -58.39 -28.87 65.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.433 179.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.191 ' CE2' HD11 ' B' ' 139' ' ' LEU . 6.4 m-30 -88.09 -42.2 12.54 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.598 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 149.21 1.82 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 O-C-N 124.294 0.997 . . . . 0.0 112.347 178.455 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.578 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 16.5 t -94.05 71.46 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 121.938 -0.476 . . . . 0.0 112.12 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.958 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -61.43 47.22 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.958 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 40.33 -4.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 178.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.609 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 0.7 OUTLIER -40.86 -55.97 2.33 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 120.066 1.303 . . . . 0.0 110.973 -178.707 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -28.1 24.45 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.499 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.651 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -63.45 -64.33 0.93 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 117.325 0.562 . . . . 0.0 110.143 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.75 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.7 t -51.3 -61.22 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.695 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 9.3 p -48.68 -27.24 2.74 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.134 178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 45.2 m -83.25 -53.28 5.88 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.524 HG21 HD21 ' B' ' 127' ' ' LEU . 10.2 m -55.33 -50.82 68.64 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.642 0.734 . . . . 0.0 109.201 178.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.963 ' HE1' HG23 ' B' ' 124' ' ' ILE . 5.3 mmt -48.89 -50.08 36.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.526 -1.216 . . . . 0.0 111.955 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.496 ' HG2' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -61.93 -47.26 85.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.499 0.19 . . . . 0.0 110.922 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 72.4 m-20 -58.16 -53.97 52.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.765 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' HD21 ' B' ' 117' ' ' LEU . 27.6 mm-40 -69.25 -30.92 69.15 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.399 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -68.34 -30.64 69.66 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.241 0.543 . . . . 0.0 109.668 177.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 3.0 mmt180 -82.4 -52.15 7.17 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.922 0.867 . . . . 0.0 110.104 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -18.69 62.8 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.593 -1.639 . . . . 0.0 114.007 -176.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.077 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER -40.05 140.76 0.54 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 118.421 0.555 . . . . 0.0 111.947 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 40' ' ' ARG . 6.0 tpt180 75.33 -37.49 0.34 Allowed 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 168.18 13.51 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 111.834 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.23 -167.89 0.1 Allowed 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.258 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' A' ' 43' ' ' ARG . 8.3 tpt180 -104.45 121.62 43.82 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.39 . . . . 0.0 112.0 -179.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -129.78 68.03 1.44 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.952 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.402 ' NZ ' ' OE1' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -141.87 161.36 38.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.885 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.745 HG13 ' CG2' ' B' ' 146' ' ' VAL . 4.7 p -179.42 139.85 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.966 0.412 . . . . 0.0 111.8 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.402 ' OE1' ' NZ ' ' A' ' 45' ' ' LYS . 5.1 pm0 -132.99 140.59 47.84 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.166 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.455 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -179.59 -154.96 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.129 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 48' ' ' ASN . 1.4 mp0 75.98 108.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.92 0.391 . . . . 0.0 111.157 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -131.45 122.08 25.64 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -176.32 -148.5 7.04 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.903 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -124.53 -102.22 0.38 Allowed 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.251 0.093 . . . . 0.0 111.251 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 t 63.59 84.95 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.074 0.464 . . . . 0.0 111.126 -179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.669 ' HA ' ' CD2' ' A' ' 72' ' ' TRP . 8.9 pt-20 -74.08 123.87 25.22 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.441 0.638 . . . . 0.0 112.321 -179.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -150.55 44.31 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.744 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.53 77.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.083 0.468 . . . . 0.0 111.879 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -111.59 -68.69 0.91 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.1 p90 176.52 159.66 0.33 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.189 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.514 HG23 ' N ' ' A' ' 60' ' ' GLU . 5.0 tt -177.22 -53.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.524 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.514 ' N ' HG23 ' A' ' 59' ' ' ILE . 7.9 tp10 -132.02 145.22 51.32 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.465 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.34 55.95 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 0.0 111.011 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -127.38 -175.58 3.49 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.856 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 86.04 104.07 0.74 Allowed Glycine 0 C--N 1.335 0.499 0 C-N-CA 121.101 -0.571 . . . . 0.0 112.303 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.55 -49.41 11.36 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.584 0.192 . . . . 0.0 111.365 -179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -165.72 -61.14 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.32 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.11 -26.8 56.74 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.898 0.38 . . . . 0.0 110.998 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.596 ' HA ' HD13 ' B' ' 139' ' ' LEU . 19.9 p-10 -100.08 149.15 23.79 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.915 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 42.98 63.43 1.49 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.403 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.75 60.24 0.16 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.21 0.529 . . . . 0.0 111.437 179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.39 -78.23 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.846 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.9 t0 57.19 -176.32 0.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 120.993 0.425 . . . . 0.0 111.849 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.669 ' CD2' ' HA ' ' A' ' 54' ' ' GLU . 6.2 m0 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.033 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.638 ' C ' ' HG2' ' B' ' 102' ' ' LYS . 3.0 mtm . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.615 0.245 . . . . 0.0 111.528 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.638 ' HG2' ' C ' ' B' ' 101' ' ' MET . 0.0 OUTLIER -156.53 170.05 23.25 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.74 179.82 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.73 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 9.8 tt0 -135.45 134.64 39.81 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.507 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 8.6 ttm105 -79.56 116.19 19.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.287 0.565 . . . . 0.0 110.033 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.925 HD13 ' CE1' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -115.4 116.37 52.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.405 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.679 HG23 ' H73' ' D' ' 191' ' ' ' DT' . 0.5 OUTLIER -121.05 127.16 51.44 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -175.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.742 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -103.73 95.64 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.953 HG22 ' HG3' ' A' ' 4' ' ' ARG . 52.8 p -70.9 91.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.938 -1.101 . . . . 0.0 109.93 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.833 ' HB ' ' HB2' ' B' ' 112' ' ' ASP . 4.4 m -132.4 -30.17 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 -177.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.844 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 7.9 t70 42.38 -88.1 0.01 OUTLIER 'General case' 0 C--N 1.343 0.302 0 CA-C-O 122.451 1.12 . . . . 0.0 108.721 -177.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.577 ' N ' ' O ' ' B' ' 109' ' ' VAL . 2.0 m -60.81 -18.31 54.66 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 112.542 -2.117 . . . . 0.0 114.991 179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.833 ' HB2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -79.5 62.3 3.78 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 120.194 1.361 . . . . 0.0 110.374 -178.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 29' ' ' SER . 17.0 m 57.98 -19.73 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.686 ' CG ' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -47.08 -54.24 10.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.496 0.665 . . . . 0.0 110.663 179.301 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.7 pt20 -50.18 -43.85 52.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.717 -1.128 . . . . 0.0 112.614 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.684 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -56.56 -45.16 81.41 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 120.874 0.369 . . . . 0.0 111.864 -179.476 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.98 ' CD1' HD12 ' B' ' 127' ' ' LEU . 0.0 OUTLIER -55.14 -47.62 74.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.774 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 0.7 OUTLIER -79.25 -33.14 43.8 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.205 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.15 66.51 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.914 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.077 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.67 -43.33 11.4 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.447 178.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 151.55 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 177.026 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.658 HG12 HD13 ' B' ' 117' ' ' LEU . 88.6 t -162.07 88.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.774 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -61.93 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.02 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -151.12 -0.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 178.453 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 8.7 t -38.71 -62.39 0.62 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.69 0.281 . . . . 0.0 110.63 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.415 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.99 -28.62 30.77 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.98 HD12 ' CD1' ' B' ' 117' ' ' LEU . 1.2 tt -62.61 -61.91 2.1 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.845 0.322 . . . . 0.0 110.902 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.02 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.9 t -53.09 -61.35 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.822 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.79 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 16.1 p -49.56 -45.58 47.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.5 OUTLIER -83.57 -50.68 8.0 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -177.806 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.575 ' HB ' HD23 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -54.47 -34.52 61.71 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -177.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.767 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.6 mmt -66.55 -52.52 44.78 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.054 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -42.06 61.35 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 122.143 -0.348 . . . . 0.0 111.191 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.3 m-20 -64.38 -55.68 19.42 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.858 0.361 . . . . 0.0 110.173 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.547 ' O ' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -67.25 -23.06 65.65 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.693 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.705 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -72.07 -40.14 68.5 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -52.85 14.12 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.842 0.83 . . . . 0.0 109.521 177.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -45.35 53.9 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.027 -177.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.191 HD11 ' CE2' ' A' ' 20' ' ' TYR . 74.8 mt 35.66 56.77 0.92 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.089 0.956 . . . . 0.0 112.337 -178.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' B' ' 139' ' ' LEU . 19.9 mtm180 -161.05 151.5 17.93 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.239 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.83 134.99 57.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.611 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.78 148.31 31.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.371 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -103.27 132.56 49.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.4 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 33.1 p90 -85.05 149.29 25.67 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.918 0.39 . . . . 0.0 111.533 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.417 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.1 OUTLIER 51.87 59.64 4.41 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.958 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.745 ' CG2' HG13 ' A' ' 46' ' ' VAL . 10.2 m -82.97 -169.71 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.5 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.35 161.94 29.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.894 0.378 . . . . 0.0 111.544 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -178.71 175.57 1.06 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.946 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.27 119.54 7.3 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.718 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 63.29 -136.5 0.38 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.553 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 172.39 159.17 18.3 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.903 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.422 ' O ' ' HB ' ' B' ' 153' ' ' VAL . 13.9 ptp -106.89 -17.19 14.27 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' B' ' 152' ' ' MET . 40.6 t 76.48 139.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.951 0.405 . . . . 0.0 111.2 -179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.536 ' HB2' ' HB2' ' B' ' 172' ' ' TRP . 0.5 OUTLIER -70.97 -50.62 32.39 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.804 -179.826 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.532 HG12 ' O ' ' B' ' 155' ' ' VAL . 12.8 t 65.11 -0.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 49.6 81.51 0.06 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.054 0.454 . . . . 0.0 111.592 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -68.83 78.52 0.31 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.427 ' O ' ' HB ' ' B' ' 159' ' ' ILE . 0.1 OUTLIER 66.77 -147.53 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.657 179.209 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.427 ' HB ' ' O ' ' B' ' 158' ' ' PHE . 70.0 mt 72.5 -56.37 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 122.615 0.366 . . . . 0.0 111.945 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.413 ' CB ' ' O ' ' B' ' 159' ' ' ILE . 1.1 tt0 83.99 166.85 0.1 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 122.833 0.453 . . . . 0.0 111.086 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -146.83 134.29 20.83 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.252 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -109.41 64.2 0.61 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.084 0.468 . . . . 0.0 111.039 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -113.5 178.34 18.46 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.943 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 6.7 m -176.15 131.51 0.23 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 122.324 0.249 . . . . 0.0 110.557 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.626 ' CB ' HG22 ' B' ' 122' ' ' VAL . 0.3 OUTLIER -168.97 173.27 7.06 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.19 -179.094 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -83.96 -88.02 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.321 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.05 86.09 0.25 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.0 0.428 . . . . 0.0 110.949 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.421 ' HB2' ' HE1' ' B' ' 165' ' ' PHE . 0.5 OUTLIER -81.57 179.75 7.71 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.944 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -112.39 39.42 2.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.442 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.25 -165.78 0.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.608 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -78.58 -141.14 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.178 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.536 ' HB2' ' HB2' ' B' ' 154' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.247 0 CA-C-O 118.779 -0.629 . . . . 0.0 111.299 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.75 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.527 0.915 0 C3'-C2'-C1' 105.817 2.226 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.75 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.631 0 C3'-C2'-C1' 105.914 2.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.727 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.526 0 O4'-C1'-C2' 107.14 0.945 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.58 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C4'-C3'-C2' 104.716 1.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.567 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.933 0 C4'-C3'-C2' 104.731 1.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.567 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.512 -0.645 0 C4'-C3'-C2' 103.961 0.761 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.51 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C3'-C2'-C1' 105.237 1.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.51 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 105.244 -0.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.429 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 C3'-C2'-C1' 104.135 1.025 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.536 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -1.009 0 C3'-C2'-C1' 105.037 1.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.605 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.66 0 C1'-O4'-C4' 110.56 0.614 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.605 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 N19-C1'-C2' 115.238 0.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.598 0 C1'-O4'-C4' 110.491 0.565 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.828 " O5'" H5'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 N19-C1'-C2' 115.202 0.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.828 H5'' " O5'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-C2' 107.028 0.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 C3'-C2'-C1' 102.051 -0.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.593 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 O4'-C1'-C2' 106.993 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.609 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.905 0 C4'-C3'-C2' 104.787 1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.679 ' H73' HG23 ' B' ' 106' ' ' THR . . . . . . . . 0 C3'--C2' 1.525 0.691 0 C3'-C2'-C1' 105.26 1.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.496 " O5'" H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 C3'-C2'-C1' 104.332 1.165 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.507 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.409 -0.837 0 C4'-C3'-C2' 104.785 1.585 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.476 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C1'-O4'-C4' 110.78 0.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.476 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.982 0 C1'-O4'-C4' 106.894 -2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.433 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.69 0 O4'-C1'-C2' 107.316 1.105 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.433 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.686 0 C4'-C3'-C2' 104.436 1.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.406 ' C6 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 C3'-C2'-C1' 101.587 -0.795 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_